Raw JSON report machine-readable
{
"data": {
"repo": {
"topics": [],
"is_fork": false,
"size_kb": 161595,
"has_wiki": true,
"homepage": null,
"languages": {
"C": 52320,
"C++": 18252421,
"Cuda": 843203,
"HTML": 1330,
"Roff": 4490,
"CMake": 180234,
"Shell": 338720,
"Python": 493794,
"Gnuplot": 2234,
"Makefile": 28621,
"Batchfile": 799,
"PureBasic": 1656
},
"pushed_at": "2026-06-26T08:33:04Z",
"created_at": "2021-01-20T03:44:16Z",
"owner_type": "Organization",
"updated_at": "2026-07-18T16:18:25Z",
"description": "An electronic structure package based on either plane wave basis or numerical atomic orbitals.",
"is_archived": false,
"is_disabled": false,
"license_spdx": "LGPL-3.0",
"default_branch": "develop",
"license_spdx_raw": "LGPL-3.0",
"primary_language": "C++",
"significant_languages": [
"C++"
]
},
"owner": {
"blog": "http://abacus.ustc.edu.cn/",
"name": null,
"type": "Organization",
"login": "abacusmodeling",
"company": null,
"location": null,
"followers": 35,
"avatar_url": "https://avatars.githubusercontent.com/u/77711195?v=4",
"created_at": "2021-01-20T03:34:01Z",
"is_verified": null,
"public_repos": 17,
"account_age_days": 2008
},
"license": {
"state": "standard",
"spdx_id": "LGPL-3.0",
"raw_spdx": "LGPL-3.0",
"file_present": true,
"scorecard_found": true,
"profile_has_license": true
},
"activity": {
"releases": [
{
"tag": "v3.9.0.19",
"kind": "other",
"published_at": "2025-11-24T10:13:57Z"
},
{
"tag": "v3.10.1",
"kind": "patch",
"published_at": "2025-11-21T08:18:41Z"
},
{
"tag": "v3.9.0.18",
"kind": "other",
"published_at": "2025-11-24T10:13:10Z"
},
{
"tag": "v3.9.0.17",
"kind": "other",
"published_at": "2025-11-24T10:12:14Z"
},
{
"tag": "v3.9.0.16",
"kind": "other",
"published_at": "2025-11-24T10:11:25Z"
},
{
"tag": "v3.9.0.15",
"kind": "other",
"published_at": "2025-11-24T10:10:46Z"
},
{
"tag": "v3.9.0.14",
"kind": "other",
"published_at": "2025-11-24T10:10:09Z"
},
{
"tag": "v3.9.0.13",
"kind": "other",
"published_at": "2025-11-24T10:09:20Z"
},
{
"tag": "v3.9.0.11",
"kind": "other",
"published_at": "2025-08-04T10:11:47Z"
},
{
"tag": "v3.9.0.10",
"kind": "other",
"published_at": "2025-07-21T12:38:16Z"
},
{
"tag": "v3.9.0.9",
"kind": "other",
"published_at": "2025-07-21T12:37:29Z"
},
{
"tag": "v3.9.0.8",
"kind": "other",
"published_at": "2025-07-21T12:36:27Z"
},
{
"tag": "v3.9.0.7",
"kind": "other",
"published_at": "2025-06-09T10:04:35Z"
},
{
"tag": "v3.9.0.6",
"kind": "other",
"published_at": "2025-06-09T10:03:41Z"
},
{
"tag": "v3.9.0.5",
"kind": "other",
"published_at": "2025-06-09T10:02:45Z"
},
{
"tag": "v3.9.0.4",
"kind": "other",
"published_at": "2025-06-09T10:02:03Z"
},
{
"tag": "v3.9.0.3",
"kind": "other",
"published_at": "2025-06-09T10:01:17Z"
},
{
"tag": "LTSv3.10.0",
"kind": "other",
"published_at": "2025-04-02T09:14:07Z"
},
{
"tag": "v3.9.0.2",
"kind": "other",
"published_at": "2025-06-09T10:00:17Z"
},
{
"tag": "v3.9.0.1",
"kind": "other",
"published_at": "2025-06-09T09:59:30Z"
},
{
"tag": "v3.9.0",
"kind": "minor",
"published_at": "2025-01-02T09:27:15Z"
},
{
"tag": "v3.8.5",
"kind": "patch",
"published_at": "2024-12-16T10:08:11Z"
},
{
"tag": "v3.8.4",
"kind": "patch",
"published_at": "2024-12-02T10:19:25Z"
},
{
"tag": "v3.8.3",
"kind": "patch",
"published_at": "2024-12-02T10:18:07Z"
},
{
"tag": "v3.8.2",
"kind": "patch",
"published_at": "2024-12-02T10:17:06Z"
},
{
"tag": "v3.8.1",
"kind": "patch",
"published_at": "2024-12-02T10:15:58Z"
},
{
"tag": "v3.8.0",
"kind": "minor",
"published_at": "2024-10-08T08:59:00Z"
},
{
"tag": "v3.7.5",
"kind": "patch",
"published_at": "2024-10-08T08:57:37Z"
},
{
"tag": "v3.7.4",
"kind": "patch",
"published_at": "2024-08-26T06:21:10Z"
},
{
"tag": "v3.7.3",
"kind": "patch",
"published_at": "2024-08-26T03:19:44Z"
},
{
"tag": "v3.7.2",
"kind": "patch",
"published_at": "2024-08-26T03:18:43Z"
},
{
"tag": "v3.7.1",
"kind": "patch",
"published_at": "2024-08-26T03:17:12Z"
},
{
"tag": "v3.7.0",
"kind": "minor",
"published_at": "2024-08-26T03:15:43Z"
},
{
"tag": "v3.6.5",
"kind": "patch",
"published_at": "2024-06-07T12:33:38Z"
},
{
"tag": "3.6.4",
"kind": "patch",
"published_at": "2024-06-07T12:04:49Z"
},
{
"tag": "v3.6.3",
"kind": "patch",
"published_at": "2024-06-07T12:02:47Z"
},
{
"tag": "v3.6.2",
"kind": "patch",
"published_at": "2024-04-28T02:13:38Z"
},
{
"tag": "v3.6.1",
"kind": "patch",
"published_at": "2024-04-28T02:10:53Z"
},
{
"tag": "v3.6.0",
"kind": "minor",
"published_at": "2024-04-01T02:56:55Z"
},
{
"tag": "v3.5.4",
"kind": "patch",
"published_at": "2024-03-04T10:16:24Z"
},
{
"tag": "v3.5.3",
"kind": "patch",
"published_at": "2024-02-19T06:03:02Z"
},
{
"tag": "v3.5.2",
"kind": "patch",
"published_at": "2024-01-30T02:30:10Z"
},
{
"tag": "v3.5.1",
"kind": "patch",
"published_at": "2024-01-15T10:17:20Z"
},
{
"tag": "v3.5.0",
"kind": "minor",
"published_at": "2023-12-29T08:01:27Z"
},
{
"tag": "v3.4.4",
"kind": "patch",
"published_at": "2023-12-25T05:07:35Z"
},
{
"tag": "v3.4.3",
"kind": "patch",
"published_at": "2023-11-20T09:54:04Z"
},
{
"tag": "v3.4.2",
"kind": "patch",
"published_at": "2023-11-04T03:10:52Z"
},
{
"tag": "v3.4.1",
"kind": "patch",
"published_at": "2023-12-25T05:27:41Z"
},
{
"tag": "v3.4.0",
"kind": "minor",
"published_at": "2023-10-07T02:50:56Z"
},
{
"tag": "v3.3.4",
"kind": "patch",
"published_at": "2023-12-25T05:25:24Z"
},
{
"tag": "v3.3.3",
"kind": "patch",
"published_at": "2023-12-25T05:23:59Z"
},
{
"tag": "v3.3.2",
"kind": "patch",
"published_at": "2023-08-14T12:58:06Z"
},
{
"tag": "v3.3.1",
"kind": "patch",
"published_at": "2023-12-25T05:21:55Z"
},
{
"tag": "v3.3.0",
"kind": "minor",
"published_at": "2023-07-13T14:48:23Z"
},
{
"tag": "v3.2.5",
"kind": "patch",
"published_at": "2023-06-16T07:51:06Z"
},
{
"tag": "v3.2.4",
"kind": "patch",
"published_at": "2023-06-02T07:42:00Z"
},
{
"tag": "v3.2.3",
"kind": "patch",
"published_at": "2023-05-19T09:43:00Z"
},
{
"tag": "v3.2.2",
"kind": "patch",
"published_at": "2023-04-28T09:38:10Z"
},
{
"tag": "v3.2.1",
"kind": "patch",
"published_at": "2023-04-13T07:48:10Z"
},
{
"tag": "v3.2.0",
"kind": "minor",
"published_at": "2023-03-31T14:11:13Z"
},
{
"tag": "v3.1.4",
"kind": "patch",
"published_at": "2023-03-10T08:41:41Z"
},
{
"tag": "v3.1.3",
"kind": "patch",
"published_at": "2023-02-24T09:07:59Z"
},
{
"tag": "v3.1.2",
"kind": "patch",
"published_at": "2023-02-10T05:38:34Z"
},
{
"tag": "v3.1.1",
"kind": "patch",
"published_at": "2023-01-13T09:58:30Z"
},
{
"tag": "v3.1.0",
"kind": "minor",
"published_at": "2022-12-30T04:26:14Z"
},
{
"tag": "v3.0.5",
"kind": "patch",
"published_at": "2022-12-16T04:39:52Z"
},
{
"tag": "v3.0.4",
"kind": "patch",
"published_at": "2022-12-01T10:04:12Z"
},
{
"tag": "v3.0.3",
"kind": "patch",
"published_at": "2022-11-18T10:24:17Z"
},
{
"tag": "v3.0.2",
"kind": "patch",
"published_at": "2022-11-04T11:29:50Z"
},
{
"tag": "v3.0.1",
"kind": "patch",
"published_at": "2022-10-21T06:58:17Z"
},
{
"tag": "v3.0.0",
"kind": "major",
"published_at": "2022-09-30T09:56:01Z"
},
{
"tag": "v2.3.5",
"kind": "patch",
"published_at": "2022-09-08T09:49:01Z"
},
{
"tag": "v2.3.4",
"kind": "patch",
"published_at": "2022-08-28T09:57:29Z"
},
{
"tag": "v2.3.3",
"kind": "patch",
"published_at": "2022-09-06T07:02:25Z"
},
{
"tag": "v2.3.2",
"kind": "patch",
"published_at": "2022-07-29T06:41:01Z"
},
{
"tag": "v2.3.1",
"kind": "patch",
"published_at": "2022-07-15T16:37:10Z"
},
{
"tag": "v2.3.0",
"kind": "minor",
"published_at": "2022-07-01T09:43:05Z"
},
{
"tag": "v2.2.4",
"kind": "patch",
"published_at": "2022-06-11T08:02:22Z"
},
{
"tag": "v2.2.3",
"kind": "patch",
"published_at": "2022-05-27T14:42:51Z"
},
{
"tag": "v2.2.2",
"kind": "patch",
"published_at": "2022-05-13T11:38:13Z"
},
{
"tag": "v2.2.1",
"kind": "patch",
"published_at": "2022-04-25T04:37:50Z"
},
{
"tag": "v2.2.0",
"kind": "minor",
"published_at": "2022-04-07T05:05:28Z"
}
],
"recent_commits": [
{
"oid": "2f59a6fcfc787a024694201c77ccfe8549c80193",
"body": "* Feature: plot sts_line_ave\n\n* Fix: dav_subspace for uspp\n\n* Fix: refresh sphi in dav_subspace\n\n* Fix: pyabacus interface\n\n* add syncmem_op for PyDiagoDavSubspace",
"is_bot": false,
"headline": "Fix: dav_subspace for uspp (#6428)",
"author_name": "Yu Liu",
"author_login": "YuLiu98",
"committed_at": "2025-08-04T03:09:53Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "acaa1fc23ae11986df7ffbb09c6052a1ae2fffeb",
"body": "* add cuda support for cal_force_loc\n\n* fix compilation bug\n\n* fix bug",
"is_bot": false,
"headline": "Perf: add cuda support for cal_force_loc (#6427)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-08-04T03:08:39Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "940a66457ec1e91845dce219c7fec7cee0de5b79",
"body": null,
"is_bot": false,
"headline": "Update version.h (#6426)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-08-02T11:38:12Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "8d76d26e1a4264538a97d922ea634cbfdf12ab4c",
"body": "Co-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "fix bug in Pseudopot_upf::set_empty_element() (#6423)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-08-01T13:36:12Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "f16364decd02228715d1d0e6ec8fed69a40a4919",
"body": "* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix Makefile Intel toolchains compile errors\n\n* Fix even more PEXSI related Makefile compiling issues\n\n* M\n[…]\nohan Chen <mohanchen@pku.edu.cn>\nCo-authored-by: Critsium <tsfxwbbzxy@163.com>\nCo-authored-by: Taoni Bao <baotaoni@pku.edu.cn>\nCo-authored-by: Chen Nuo <49788094+Cstandardlib@users.noreply.github.com>",
"is_bot": false,
"headline": "Feature: EXX PW GPU Support (#6407)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-07-31T14:05:36Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "3f7e7a4b2a43c757d5ea2f9e8331e93906c9bb56",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\nohan Chen <mohanchen@pku.edu.cn>\nCo-authored-by: Critsium <tsfxwbbzxy@163.com>\nCo-authored-by: Taoni Bao <baotaoni@pku.edu.cn>\nCo-authored-by: Chen Nuo <49788094+Cstandardlib@users.noreply.github.com>",
"is_bot": false,
"headline": "Fix: wrong name in cuda \"lapack\" interface (#6411)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-07-31T02:10:13Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "2fcc64e3d53ecdda11e044763056a57a8ffa091c",
"body": "* Fix numerical error in pyabacus.\n\n* Add test for TwoCenterIntegrator for pyabacus.\n\n* Update numerica_radial.cpp.",
"is_bot": false,
"headline": "Fix: Numerical error in pyabacus. (#6414)",
"author_name": "Erjie Wu",
"author_login": "ErjieWu",
"committed_at": "2025-07-26T13:22:41Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "355eaf331d3e4e82337727be5afa342cae9635c7",
"body": "* Remove unreferenced header lapack_connector in source_hsolver/test\n\n* Remove unreferenced header lapack_connector in source_hsolver/kernels\n\n* Remove unreferenced header blas_connector in tests",
"is_bot": false,
"headline": "Remove blas/lapack_connector.h that are not referenced in test (#6413)",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-25T09:25:54Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "afd9b089e9cb4299eaeabece8207ee6d46d39798",
"body": "* Add files via upload\n\n* Add files via upload",
"is_bot": false,
"headline": "Fix rt-tddft crash (#6410)",
"author_name": "HTZhao",
"author_login": "ESROAMER",
"committed_at": "2025-07-23T14:04:44Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "a52361b819fe53ba1900fa59671f235332e3c69d",
"body": "* Update FetchContent URL for cereal to use the latest master version\n\n* Use std::abs instead of abs to suppress warning message\n\"using integer absolute value function 'abs' when argument is of floating point type [-Wabsolute-value]\"",
"is_bot": false,
"headline": "Refactor: changed cereal url with codeload (#6408)",
"author_name": "Kai Luo (罗凯)",
"author_login": null,
"committed_at": "2025-07-23T14:02:37Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "61c325c10abfdefb0a5ccf55137278ecb2297378",
"body": "* Remove unreferenced header lapack_connector in source_hsolver\n\n* Remove unreferenced header lapack_connector in source_esolver\n\n* Remove unreferenced header lapack_connector in source_relax\n\n* Remove unreferenced header lapack_connector in source_hsolver\n\n* Remove unreferenced header lapack_connector in source_io\n\n* Remove unreferenced header lapack_connector in source_lcao/module_rt\n\n* Remove unreferenced header lapack_connector in source_hsolver",
"is_bot": false,
"headline": "Remove lapack_connector.h that are not referenced (#6400)",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-23T14:01:52Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "954d24a675e618b55ed2f2d994b3125f1d37171f",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\nohan Chen <mohanchen@pku.edu.cn>\nCo-authored-by: Critsium <tsfxwbbzxy@163.com>\nCo-authored-by: Taoni Bao <baotaoni@pku.edu.cn>\nCo-authored-by: Chen Nuo <49788094+Cstandardlib@users.noreply.github.com>",
"is_bot": false,
"headline": "Fix: fix exx_gamma_extrapolation error in MPI (#6404)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-07-22T05:41:10Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "939582f317edcd46345a72338a9287af628b1f9a",
"body": "…ue control flow. (#6403)",
"is_bot": false,
"headline": "Fix control flow of occNum_func in rdmft_tools to include default val…",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-21T14:21:51Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "3b51a108dea38368980f4c6a86fd75fb5ac02d38",
"body": "…overridden (#6401)",
"is_bot": false,
"headline": "explicitly introduce push_data version of the base class that is not …",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-21T14:21:15Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "23421806a7dbe3f7f007ebe3644de27af25dc7e7",
"body": "… include directly and will be removed in future CUDA release, eliminating compile warning by nvcc. (#6399)",
"is_bot": false,
"headline": "Remove internal header file device_functions.h that is not allowed to…",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-21T14:20:24Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "93cd909c5e54ead46f3b6d582c0aad4cf29a614c",
"body": "* Remove unreferenced header blas_connector in hsolver\n\n* Remove unreferenced header blas_connector in source_lcao/module_gint\n\n* Remove unreferenced header blas_connector in source_lcao/module_ri\n\n* Remove unreferenced header blas_connector in source_lcao/module_operator_lcao\n\n* Remove unreferenced\n[…]\n Remove unreferenced header blas_connector in source_pw/module_stodft\n\n* Remove unreferenced header blas_connector in source_pw/module_pwdft\n\n* Remove unreferenced header blas_connector in source_base",
"is_bot": false,
"headline": "Remove unreferenced blas_connector.h header (#6398)",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-21T14:19:51Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "dc02067edb121173ff37b40e76ba604ca7ddc66e",
"body": "…ually referenced (#6396)\n\n* Clean dependency: remove headers scalapack_connector that are not actually referenced\n\n* Remove header in hsolver test\n\n* Remove header in module_deltaspin\n\n* Remove header in source_lcao/module_dftu\n\n* Remove unreferenced header in source_io\n\n* Remove unreferenced header in source_lcao/module_rt",
"is_bot": false,
"headline": "Clean dependency: remove headers scalapack_connector that are not act…",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-21T14:18:27Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "a94c62d265d825f39a8d6b3b52c35e8ec68d887d",
"body": "Co-authored-by: Liang Sun <50293369+sunliang98@users.noreply.github.com>",
"is_bot": false,
"headline": "bump version to 3.9.0.10 (#6397)",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-07-20T01:09:39Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "fe38a7021985dd60dcc5b1fde57d5682cbd4c197",
"body": "* update the output formats of rt-TDDFT\n\n* update the output formats of rt-TDDFT\n\n* fix a bug\n\n* update initialized velocities\n\n* found some output information is still lacking in MD module\n\n* update output information\n\n* remove some global variables in relax_driver\n\n* update outputs\n\n* update relax\n[…]\nan the cell length, it is fine to proceed the relaxation calculations\n\n* fix tests for unitcells\n\n* update cell\n\n* update some function names, update output A to Angstrom\n\n* change eV/A to eV/Angstrom",
"is_bot": false,
"headline": "Fix a bug for the output information after relaxation (#6395)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-07-19T11:30:15Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "063bd69e11afbc8ab0a31760f7934e26f81e2e85",
"body": "…external in source_base (#6388)\n\n* Move module_lr to source_lcao\n\n* Fix test build\n\n* Move blas_connector to module_external\n\n* Fix header use\n\n* Fix internal header use\n\n* A fierce battle with Makefile😡\n\n* Move blacs_connector.h to module_external\n\n* Move lapack_connector.h and lapack_wrapper.h to module_external\n\n* Fix header usage\n\n* Move scalapack_connector.h to module_external",
"is_bot": false,
"headline": "[Refactor] Move module_lr to source_lcao and add a new folder module_…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-07-19T07:35:28Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "6d035e76c1d5c301c062a4b66bd6efc5103e7cde",
"body": "* support GPU version of cal_force_cc with LCAO basis\n\n* fix a bug",
"is_bot": false,
"headline": "Perf: support GPU version of cal_force_cc with LCAO basis (#6392)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-07-19T07:17:42Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "7edc682b445021b572de896ecfb77c66255666b2",
"body": null,
"is_bot": false,
"headline": "Optimize RT-TDDFT dipole output (#6393)",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-07-18T12:36:31Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "14ae255c8225f54b89276a0f18b464f719352d28",
"body": "…en `device=gpu` (#6391)\n\n* Fix GPU output of out_pchg and out_wfc_norm, out_wfc_re_im\n\n* GPU integrate test is functional again",
"is_bot": false,
"headline": "Feature: Output real space wavefunction and partial charge density wh…",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-07-18T12:35:31Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "b994d95ab08476598ddab329189602d65585e336",
"body": "* Feature: support output the matrix representation of symmetry operation\n\n* Feature: support the output of matrix representation of symm_ops\n\n* update the document",
"is_bot": false,
"headline": "Feature: support the output of matrix representation of symm_ops (#6390)",
"author_name": "kirk0830",
"author_login": "kirk0830",
"committed_at": "2025-07-18T12:32:47Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "23271d2da0493415835f692d2d58ff59c13f57b4",
"body": "* update the output formats of rt-TDDFT\n\n* update the output formats of rt-TDDFT\n\n* fix a bug\n\n* update initialized velocities\n\n* found some output information is still lacking in MD module\n\n* update output information\n\n* remove some global variables in relax_driver\n\n* update outputs\n\n* update relax\n[…]\n output stress format\n\n* change update_cell.cpp algorithm, when the ion move is larger than the cell length, it is fine to proceed the relaxation calculations\n\n* fix tests for unitcells\n\n* update cell",
"is_bot": false,
"headline": "Update the outputs of geometry relaxation (#6387)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-07-14T14:58:22Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "7aa668ae1e7a1d13b2260400bb877c536458d367",
"body": "…#6386)\n\n* Rename grid to module_grid\n\n* Rename genelpa to module_genelpa\n\n* Fix cmake",
"is_bot": false,
"headline": "[Refactor] Rename grid to module_grid and genelpa to module_genelpa (…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-07-14T07:32:27Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "d48a64608eba50c81e0a047bf61462a61e8017ec",
"body": "* update the output formats of rt-TDDFT\n\n* update the output formats of rt-TDDFT\n\n* fix a bug\n\n* update initialized velocities\n\n* found some output information is still lacking in MD module",
"is_bot": false,
"headline": "Update the output formats of rt-TDDFT (#6381)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-07-13T08:20:19Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "9cfddf3a10311b129169b6b35a395fe9274c2774",
"body": "* remove float error in sunway\n\n* fix ig=0\n\n* add the sw\n\n* change the make_dir\n\n* unify the gg use\n\n* fix compile bug\n\n* add init\n\n* temporarily remove the sunway define\n\n* add the pesduo\n\n* fix compile bug\n\n* fix bug in the betar\n\n* modify the test",
"is_bot": false,
"headline": "Add use sw and fix Floating point exception (#6372)",
"author_name": "liiutao",
"author_login": "A-006",
"committed_at": "2025-07-12T13:37:13Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "3f312e8a8f5f47c48ac3417ab500ee57083d4c83",
"body": "Co-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "refactor Exx_Opt_Orb (#6378)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-07-12T13:34:54Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "012c2169b56519dfb9c52f2151fe83f1aaf9ff9d",
"body": "* fix memory leak\n\n* delete copy assignment",
"is_bot": false,
"headline": "Fix: Fix memory leak introduced by new gint module (#6375)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-07-10T16:54:40Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "7c68dfc9a2a8fb7a265fa7f0cd99e63430f1c494",
"body": "* Refactor: Replace PARAM.inp with inp in ESolver classes for consistency\n\n* Refactor: Replace local input parameters with PARAM.inp in ESolver classes for consistency\n\n* Refactor: Use PARAM.inp.scf_ene_thr in ESolver_KS_LCAO iter_finish method\n\n* Revert \"Refactor: Use PARAM.inp.scf_ene_thr in ESolv\n[…]\na46630cd0acddc392e8ca8f7a22918c4f.\n\n* Revert \"Refactor: Replace local input parameters with PARAM.inp in ESolver classes for consistency\"\n\nThis reverts commit f4f81e3902315e4446a55094ee93ff771eb68855.",
"is_bot": false,
"headline": "Refactor: Remove redundant Input_para from ESolver Class (#6370)",
"author_name": "Liang Sun",
"author_login": "sunliang98",
"committed_at": "2025-07-10T05:21:32Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "b8e9264f01df592ad6add6bb0b39b7312a6d0589",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Feature: Support linear combination of coulomb_param for EXX PW (#6371)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-07-10T01:25:55Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "db416007d6d7339d31b088d6b44196ea8c9505da",
"body": "* Improve md calculation stress output in running log\n\n* Module_IO Unittest modify\n\n* ModuleMD Unittests modify\n\n* modify code comment in fire_test.cpp\n\n* maintain setprecision(8) for md stress output",
"is_bot": false,
"headline": "Improve md calculation stress output in running log (#6366)",
"author_name": "lanshuyue",
"author_login": "lanshuyue",
"committed_at": "2025-07-10T01:11:03Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "8e8c30fb431e46b75a8ccd47a3dd0f57301a21f6",
"body": "* hybrid gague\n\n* update tests\n\n* update\n\n* update\n\n* update\n\n* update\n\n* update unit test\n\n* fix tests\n\n* update tests\n\n* fix read_wfc\n\n* fix catch_properties.sh\n\n* fix restart\n\n* update gpu test\n\n* update tests\n\n* fix\n\n* fix input_conv",
"is_bot": false,
"headline": "Uploading hybrid gauge tddft (#6369)",
"author_name": "HTZhao",
"author_login": "ESROAMER",
"committed_at": "2025-07-10T01:07:17Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "b554f40abdb44dde642f99fa711e2da05c64bd00",
"body": null,
"is_bot": false,
"headline": "Print eigenvalues for all k-points in running log when kpar > 1 (#6367)",
"author_name": "lanshuyue",
"author_login": "lanshuyue",
"committed_at": "2025-07-09T01:20:22Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "3a842b009401d2cf02165dd67cdfc19d88f97185",
"body": "* Use template to reconstruct parse_expression\n\n* Feature: output R matrix at each MD step\n\n* Modify'matrix_HS' to 'matrix' for R matrix output\n\n* Merge branches 'develop' and 'develop' of https://github.com/1041176461/abacus-develop into develop\n\n* Fix: modify index in parse_expression\n\n* Fix: add \n[…]\nby: HTZhao <104255052+ESROAMER@users.noreply.github.com>\nCo-authored-by: maki49 <1579492865@qq.com>\nCo-authored-by: pre-commit-ci-lite[bot] <117423508+pre-commit-ci-lite[bot]@users.noreply.github.com>",
"is_bot": false,
"headline": "Refactor: the initialization scheme in LRI_CV (#6363)",
"author_name": "jiyuyang",
"author_login": "1041176461",
"committed_at": "2025-07-08T06:19:06Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "c873197784aa63e77facec7c97f43556ef924eb0",
"body": "… (#6358)\n\n* Move module_parameter to source_io\n\n* Move operator_lcao out and rename\n\n* Modify source_lcao folder structure\n\n* Fix test probelm\n\n* Fix Conflict and fix compilation",
"is_bot": false,
"headline": "[Refactor] Move module_parameter to source_io. Reorganize source_lcao…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-07-05T07:36:44Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "83709c975c633075e19bb393aac58d2ac46f6fbb",
"body": "* Feature: Implement Xu-Wang-Ma KEDF\n\n* Test: Add two integrate tests for XWM KEDF\n\n* Doc: Update document of XWM KEDF.\n\n* Fix: update kedf_manager.h",
"is_bot": false,
"headline": "Feature: Implement Xu-Wang-Ma KEDF (#6359)",
"author_name": "Liang Sun",
"author_login": "sunliang98",
"committed_at": "2025-07-05T05:53:34Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "3bb2226365eba7b18211272ef32e85c70772eb1c",
"body": "Co-authored-by: Liang Sun <50293369+sunliang98@users.noreply.github.com>",
"is_bot": false,
"headline": "update version (#6360)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-07-04T12:00:16Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "ab49ad984d25db311019e84a2de57e2a9029699a",
"body": "…Spencer-Alavi truncation Coulomb potential (#6351)\n\n* Use template to reconstruct parse_expression\n\n* Feature: output R matrix at each MD step\n\n* Modify'matrix_HS' to 'matrix' for R matrix output\n\n* Merge branches 'develop' and 'develop' of https://github.com/1041176461/abacus-develop into develop\n\n[…]\nby: HTZhao <104255052+ESROAMER@users.noreply.github.com>\nCo-authored-by: maki49 <1579492865@qq.com>\nCo-authored-by: pre-commit-ci-lite[bot] <117423508+pre-commit-ci-lite[bot]@users.noreply.github.com>",
"is_bot": false,
"headline": "Feature: long-range corrected hybrid functionals implementation with …",
"author_name": "jiyuyang",
"author_login": "1041176461",
"committed_at": "2025-07-04T09:24:39Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "4b1566311db182b82843928bc55d316cb91178db",
"body": "…U CI/CD test case `07_NO_EDM_TDDFT_GPU` is functional again (#6354)\n\n* Fix ekb MPI sync error in RT-TDDFT\n\n* Add back integrate test 07_NO_EDM_TDDFT_GPU\n\n* Delete useless myid",
"is_bot": false,
"headline": "Fix: Add MPI synchronization for `ekb` band energy tensor, and now GP…",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-07-04T04:21:19Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "918d11bb2f0333d1b3a2a6d40609da78545d9cf0",
"body": null,
"is_bot": false,
"headline": "Fix calculation type inconsistency across MPI ranks (#6356)",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-07-04T04:19:44Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "f5e43ab062f659cd3d36435a723a39882ffdf4a2",
"body": "… hamilt_pwdft (#6353)\n\n* Rename module_tddft\n\n* Rename hamilt_ofdft\n\n* Renamd hamilt_ofdft\n\n* Rename hamilt_pwdft\n\n* Align doucments",
"is_bot": false,
"headline": "[Refactor] Rename module_tddft and hamilt_ofdft and hamilt_stodft and…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-07-03T06:22:03Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "ca96d8eb0218a6dad3990021512466087f764b6e",
"body": null,
"is_bot": false,
"headline": "type 1 fix with std::complex (#6346)",
"author_name": "Kai Luo (罗凯)",
"author_login": null,
"committed_at": "2025-07-02T14:49:24Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "47bfd69bead325c5f46b621dc200b3b9c11e2702",
"body": "* Refactor KEDF management in ESolver_OF\n\n- Introduced KEDF_Manager class to encapsulate KEDF functionalities, replacing individual KEDF instances (TF, VW, WT, LKT, ML) in ESolver_OF.\n- Updated ESolver_OF to initialize and utilize KEDF_Manager for potential, energy, energy density, and stress calculations.\n\n* Update Makefile.Objects",
"is_bot": false,
"headline": "Refactor: Refactor KEDF management in ESolver_OF (#6349)",
"author_name": "Liang Sun",
"author_login": "sunliang98",
"committed_at": "2025-07-02T13:56:58Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "8528f511a11d78b7ca0f3563bb9a73423420cbdd",
"body": "* Use template to reconstruct parse_expression\n\n* Feature: output R matrix at each MD step\n\n* Modify'matrix_HS' to 'matrix' for R matrix output\n\n* Merge branches 'develop' and 'develop' of https://github.com/1041176461/abacus-develop into develop\n\n* Fix: modify index in parse_expression\n\n* Fix: add \n[…]\nby: HTZhao <104255052+ESROAMER@users.noreply.github.com>\nCo-authored-by: maki49 <1579492865@qq.com>\nCo-authored-by: pre-commit-ci-lite[bot] <117423508+pre-commit-ci-lite[bot]@users.noreply.github.com>",
"is_bot": false,
"headline": "Refactor: new ccp param framework (#6350)",
"author_name": "jiyuyang",
"author_login": "1041176461",
"committed_at": "2025-07-02T11:30:18Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "174f31f68b4f95c5875a03f5f43e063fd9a0fee1",
"body": "…o source_lcao/module_rdmft and correct some documents (#6344)\n\n* Move module_ri to source_lcao/module_ri\n\n* Modify pathes of file in source_lcao/module_ri\n\n* Fix CMakeFiles in test\n\n* Move module_rdmft to source_lcao/module_rdmft\n\n* Correct documentation\n\n* Line up document\n\n* Fix document about source_relax",
"is_bot": false,
"headline": "[Refactor] Move module_ri to source_lcao/module_ri and module_rdmft t…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-07-01T04:35:56Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "2260530c45659f1e2eb8fe14b5c38216672dd5fc",
"body": "…ated docs and examples (#6345)\n\n* Update docs related to wfc and modify examples\n\n* Remove write_psi_r_1 interface from ABACUS",
"is_bot": false,
"headline": "Remove useless and outdated `write_psi_r_1` interface and improve rel…",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-07-01T04:32:52Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "e7917d49bcbe96b1e8dbc3dbe55587b8ec94d1e1",
"body": "* add #TOTAL ENERGY# for each ion step\n\n* fix bug",
"is_bot": false,
"headline": "Add \"#TOTAL ENERGY#\" after each ion step (#6342)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-07-01T04:29:34Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "adaa38e9bceefef94eee380b54cd5044a9354aad",
"body": null,
"is_bot": false,
"headline": "Rename module_md module_relax module_hamilt_lcao module_io (#6340)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-27T13:49:32Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "96730e8bcc935df95f09e1f515c69f7172ffd314",
"body": "…#6296)\n\n* version 0.0\n\n* change gemm function\n\n* enable gint_vl_gpu\n\n* add new gemm function\n\n* support rho calculation\n\n* enable fvl calculation\n\n* small change\n\n* enable vlocal-metagga and tau calculation\n\n* add set ddphi\n\n* enable gint_vl_nspin4_gpu\n\n* add gint_vl_metagga_nspin4_gpu\n\n* enable fv\n[…]\n module_lr\n\n* replace module with source\n\n* include missing header\n\n* fix a bug\n\n* update some result.ref\n\n* fix compilation error when MPI is disabled\n\n* add makefile support\n\n* fix compilation error",
"is_bot": false,
"headline": "new gint module (This is a big PR that replaces old integral codes) (…",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-06-27T09:02:33Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "96316975ec30e07205914f4df8f9ff55e4f289e5",
"body": "…pace wave function and partial charge density (#6336)\n\n* Refactor get_pchg for LCAO, remove nbands_istate\n\n* Delete useless CASES_mylist.txt\n\n* Refactor get_pchg for PW, remove useless function input\n\n* Remove useless header files in get_pchg_lcao.h\n\n* Rename IState_Charge to Get_pchg_lcao\n\n* Refactor get_wf for LCAO, remove nbands_istate\n\n* Remove useless header files and cout message in get_wf_lcao\n\n* Unify wf naming in get_wf_pw\n\n* Remove nbands_istate from ABACUS",
"is_bot": false,
"headline": "Remove INPUT parameter `nbands_istate` and unify the naming of real s…",
"author_name": "Taoni Bao",
"author_login": "AsTonyshment",
"committed_at": "2025-06-26T14:26:18Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "37bc08a78e61f0865c30f508b68c85d73810e352",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Fix: Fix Compile Error on CUDA Version > 12.9 (#6337)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-06-26T13:47:27Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "3e3f708edc708c53a39cad8dc7f9d1f36000ea6c",
"body": "…w (#6334)\n\n* Rename module_elecstate to source_estate\n\n* Rename module_psi to source_psi\n\n* Rename module_hamilt_pw to source_pw\n\n* Rename module_hamilt_general to source_hamilt",
"is_bot": false,
"headline": "[Refactor] Rename module_elecstate and module_psi and module_hamilt_p…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-25T14:18:30Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "17d9f1d96ab1efff9846c5d83a8671a41c9c3047",
"body": "…elated code (#6330)\n\n* Remove scc calculation deprecated code of traditional Davidson algorithm.\n\n* Remove scc completely in traditional Davidson.\n\n* Fix test after removal of scc",
"is_bot": false,
"headline": "Refactor: clean Davidson code, remove deprecated overlap matrix scc r…",
"author_name": "Chen Nuo",
"author_login": "Cstandardlib",
"committed_at": "2025-06-24T16:22:41Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "286131292ccfcf91d2499956ad2c11d3d719ddbd",
"body": "* don't mix_dmr in the last step\n\n* fix test reference values",
"is_bot": false,
"headline": "Fix: skip mix_dmr after the last iteration (#6331)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-06-24T16:20:55Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "71a7b2d3adf9b988cdf3f54f05e162b9afbcac20",
"body": "…T (#6329)",
"is_bot": false,
"headline": "Refactor: release the limit (<150) on length of comment lines of INPU…",
"author_name": "kirk0830",
"author_login": "kirk0830",
"committed_at": "2025-06-23T13:49:57Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "80c5265df0309a4b5efe52e7d383159d386298fe",
"body": "…tput eigenvalue information issue (#6326)\n\n* update output files\n\n* keep updating the output information in running log\n\n* update output formats\n\n* change the file name of write_istate_info write_eig_occ\n\n* update output of band information\n\n* update output of eigenvalues, delete useless functions\n\n[…]\nupdate pband\n\n* update DOS info\n\n* fix two tests\n\n* update dH and T(R) matrix output information\n\n* update elecstate_print_test\n\n* update file name of dH/dR\n\n* update examples of dhrxs1\n\n* update test",
"is_bot": false,
"headline": "Reformat running log, delete 'printe' command in INPUT and fix the ou…",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-23T13:48:32Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "eb9b2283afafc73915437f86c1a8de642e1c69ee",
"body": "…ic steps (#6325)\n\n* add parameter \"deepks_out_freq_elec\"\n\n* set global_deepks_label_elec_dir, make the directory named \"DeePKS_Label_Elec\" when needed\n\n* output files during electronic steps, add function get_filename to simplify the process\n\n* modify get_filename\n\n* change the output process of de\n[…]\ns labels during electronic steps\n\n* add test for deepks_out_freq_elec > 0\n\n* optimize LCAO_deepks_interface\n\n* modify test script for deepks\n\n* add doc for deepks_out_freq_elec\n\n* Update input-main.md",
"is_bot": false,
"headline": "Add deepks_out_freq_elec for outputting deepks labels during electron…",
"author_name": "Xinyuan Liang",
"author_login": "xuan112358",
"committed_at": "2025-06-22T04:52:52Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "7f417b28b841faa92c9c5359308b0fe997bfe137",
"body": "…ce_cell (#6319)\n\n* Rename module_basis to source_basis\n\n* Rename module_cell to source_cell\n\n---------\n\nCo-authored-by: Mohan Chen <mohanchen@pku.edu.cn>",
"is_bot": false,
"headline": "[Refactor] Rename module_basis to source_basis || module_cell to sour…",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-21T13:56:42Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "f0490592ef2afd4bf2d0fedf691d3eb7c89ce108",
"body": "* Move DeePKS printing message from screen to log file.\n\n* Add support for DeePKS Real space Hamiltonian.\n\n* Fix a merge bug.\n\n* Add DeePKS V_delta_R support in doc&value_check.\n\n* Add integrate test for deepks_v_delta<0.\n\n* Remove redundant code.\n\n* Fix the bug that DeePKS integrate test output 0/1 file.\n\n* Add UT for DeePKS H(R).\n\n* clang-format change.\n\n---------\n\nCo-authored-by: Mohan Chen <mohanchen@pku.edu.cn>",
"is_bot": false,
"headline": "Feature&Doc&Tests: Support for deepks_v_delta=-1&-2 (#6245)",
"author_name": "Erjie Wu",
"author_login": "ErjieWu",
"committed_at": "2025-06-21T09:15:17Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "867adf7ca114241f50a0d59690d470ce3b84a772",
"body": "* change INPUT exx_ for linear combination of coulomb_param\n\n* git revert a1452937d02b0fb18\n\n* update read_input_ptest.cpp, read_input_item_test.cpp, integrate_tests/INPUT\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>\nCo-authored-by: Mohan Chen <mohanchen@pku.edu.cn>",
"is_bot": false,
"headline": "change INPUT exx_ for linear combination of coulomb_param (#6316)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-21T02:45:12Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "9cd3350d162c9971191a66be929748cadeb54245",
"body": "…o not recommend using unordered_map, which has defects in C++11) (#6318)\n\n* change INPUT exx_ for linear combination of coulomb_param\n\n* git revert a1452937d02b0fb18\n\n* remove deprecated INPUT exx parameters\n\n* 1. change Exx_Info_Global::coulomb_param from unordered_map to map\n2. move exx_symmetry_\n[…]\n_input_item_test.cpp, integrate_tests/INPUT\n\n* add threshold in integrate test 002_NO_GO_AF\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>\nCo-authored-by: Mohan Chen <mohanchen@pku.edu.cn>",
"is_bot": false,
"headline": "1. change Exx_Info_Global::coulomb_param from unordered_map to map (D…",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-21T02:22:56Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "44ff32eb552623caa961c4ec527b1a493a628b48",
"body": null,
"is_bot": false,
"headline": "Fix reinterpret bug for c10::complex<double>. (#6321)",
"author_name": "Erjie Wu",
"author_login": "ErjieWu",
"committed_at": "2025-06-21T02:11:17Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "7620b59e01850020c00587830ae0cfdb630824fd",
"body": null,
"is_bot": false,
"headline": "Update version.h (#6320)",
"author_name": "Xinyuan Liang",
"author_login": "xuan112358",
"committed_at": "2025-06-20T08:00:27Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "8419964626df3b117500dc3f09a19f83e452ee02",
"body": "* change INPUT exx_ for linear combination of coulomb_param\n\n* git revert a1452937d02b0fb18\n\n* remove deprecated INPUT exx parameters\n\n* update read_input_ptest.cpp, read_input_item_test.cpp, integrate_tests/INPUT\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "remove deprecated INPUT exx parameters (#6317)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-20T03:25:08Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "5f96c22f3ef960562cd55a4e670f08e33b6f8a50",
"body": "* print out geometry information during bfgs_trad relax\n\n* print out geometry information during bfgs_trad relax",
"is_bot": false,
"headline": "print out geometry information during bfgs_trad relax (#6314)",
"author_name": "lanshuyue",
"author_login": "lanshuyue",
"committed_at": "2025-06-19T09:49:13Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "8d6b780f7c9cc9ae44cb6f38b15152f4608048a8",
"body": "…ut` for clarity (#6313)\n\n* Refactor: change the name of keyword `force_thr_ev2` to `force_zero_out` for clarity\n\n* update the name of variable in unittest\n\n* update testfile",
"is_bot": false,
"headline": "Refactor: change the name of keyword `force_thr_ev2` to `force_zero_o…",
"author_name": "kirk0830",
"author_login": "kirk0830",
"committed_at": "2025-06-19T09:48:25Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "abcb9f237e6e1b837a7ecccc395ee759cd28669f",
"body": "* Rename module_base to source_base\n\n* Update Makefile",
"is_bot": false,
"headline": "[Refactor] Rename module_base to source_base (#6311)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-19T09:47:29Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "a1452937d02b0fb18361612a0c52521e19f1a091",
"body": "…struction methods. (#6307)\n\n* Use template to reconstruct parse_expression\n\n* Feature: output R matrix at each MD step\n\n* Modify'matrix_HS' to 'matrix' for R matrix output\n\n* Merge branches 'develop' and 'develop' of https://github.com/1041176461/abacus-develop into develop\n\n* Fix: modify index in \n[…]\nby: HTZhao <104255052+ESROAMER@users.noreply.github.com>\nCo-authored-by: maki49 <1579492865@qq.com>\nCo-authored-by: pre-commit-ci-lite[bot] <117423508+pre-commit-ci-lite[bot]@users.noreply.github.com>",
"is_bot": false,
"headline": "Refactor: the ccp parameters to support additional Coulomb matrix con…",
"author_name": "jiyuyang",
"author_login": "1041176461",
"committed_at": "2025-06-19T05:04:23Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "fe446791725e24019a4f6f6412d8be8a21476c69",
"body": "* update bfgs method\n\n* update bfgs method and modify the parameter force in relax_step to be passed by reference\n\n* update bfgs method and modify the parameter force in relax_step to be passed by reference\n\n* Introduce the differences between the two BFGS methods\n\n* Add & in relax_step input parame\n[…]\nRefactor the code and add comments\n\n* Modify comments\n\n* remove auto\n\n* remove auto\n\n* remove auto\n\n* remove auto\n\n* remove auto\n\n* combine relax_new with relax_old\n\n* combine relax_new with relax_old",
"is_bot": false,
"headline": "Combine relax_new with relax_old (#6303)",
"author_name": "费扬",
"author_login": "19hello",
"committed_at": "2025-06-18T13:36:10Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "9ac5750efe312abb0bbad543f4681b6dd5653cc0",
"body": "* add write_libxc_r\n\n* 1. chage file_name of write_xc_r according to v3.9.0.7\n2. fix bug of write_xc_r when compiled without Libxc\n3. add description in input-main.md\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "add write_libxc_r (#6293)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-18T05:01:13Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "9efc3e9ef8fa57260fdbb88034ae2e097de0f10d",
"body": "* Rename module_hsolver to source_hsolver\n\n* Move .dat files into new directory",
"is_bot": false,
"headline": "[Refactor] Rename module_hsolver to source_hsolver (#6305)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-18T00:57:21Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "dc4a8f5306880bdb07457348e0e38749629be38f",
"body": "Co-authored-by: haozhihan <haozhi.han@stu.pku.edu.cn>",
"is_bot": false,
"headline": "Rename module_esolver to source_esolver (#6300)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-17T08:39:12Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "5011d10aebebb1bc9266bd50674a6f176659527d",
"body": "* update PCHG\n\n* update output file names of pchg\n\n* update reference data for PW tests\n\n* delete useless 074 example in 01_PW tests\n\n* update result.ref\n\n* update pchg output\n\n* delete a test in 01_PW\n\n* add ctrl_output_fp files\n\n* update tests in 01_PW\n\n* comment out a test in 11_PW_GPU",
"is_bot": false,
"headline": "Update output filenames for PCHG (#6299)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-17T08:36:23Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "415390d5ea1e7d8dcb824b4569e8c535dca29301",
"body": "* Use template to reconstruct parse_expression\n\n* Feature: output R matrix at each MD step\n\n* Modify'matrix_HS' to 'matrix' for R matrix output\n\n* Merge branches 'develop' and 'develop' of https://github.com/1041176461/abacus-develop into develop\n\n* Fix: modify index in parse_expression\n\n* Fix: add \n[…]\nby: HTZhao <104255052+ESROAMER@users.noreply.github.com>\nCo-authored-by: maki49 <1579492865@qq.com>\nCo-authored-by: pre-commit-ci-lite[bot] <117423508+pre-commit-ci-lite[bot]@users.noreply.github.com>",
"is_bot": false,
"headline": "Feature: add complex erf function (#6301)",
"author_name": "jiyuyang",
"author_login": "1041176461",
"committed_at": "2025-06-17T08:29:58Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "eb7b555cafd5e4553c03916eeefebab018aa0172",
"body": "* refactor Exx_Info::coulomb_param for RI\n\n* refactor in_built_xc_func_ext_params()\n\n* add precision in ModuleBase::GlobalFunc::TO_STRING()\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "refactor `Exx_Info::coulomb_param` for RI (#6295)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-16T12:31:27Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "9b0c1f71f9834542132a9550a53043feec641ac9",
"body": "* Move certain files to source_main\n\n* Fix MakeFile\n\n* Fix Makefile 2\n\n* Fix MakeFile 3\n\n* Fix Makefile 4\n\n* Fix Makefile 5\n\n* Fix Makefile 6\n\n* Fix Makefile 8\n\n* Fix Makefile 8\n\n* Fix Makefile 9\n\n* Fix Makefile 10",
"is_bot": false,
"headline": "[Refactor] Move certain files to source_main (#6290)",
"author_name": "Critsium",
"author_login": "Critsium-xy",
"committed_at": "2025-06-16T12:29:33Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "725baaf46f8989ebd512cba91f9b624cdaa30981",
"body": "* begin changing the output file names of out_mat_hs\n\n* update output vxc an output tk\n\n* Fix example 006_NO_GO_OH in 02_NAO_Gamma\n\n* fix a bug\n\n* fix 17_NO_KP_OH example in 03_NAO_multik\n\n* partly update the 19_NO_KP_OH_nscf exxample and related codes\n\n* partly update 20_NO_KP_OHS_S4\n\n* fix the exa\n[…]\nate reference data for DOS\n\n* fix a bug in example 05_NO_KP_DJ_OC2\n\n* fix bug\n\n* update SDFT DOS\n\n* update dos ref\n\n* update DOS examples\n\n* update deepks examples\n\n* add index for examples\n\n* add KPT",
"is_bot": false,
"headline": "Change examples and update DOS files, etc. (#6291)",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-13T14:57:47Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "61268435eedb2e92efd3f2ae89d0f1a13522edc5",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Refactor: Optimize the code structure of K_Vectors (#6263)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-06-13T12:01:44Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "6742c156a4d55faaacdf6f98ba0b6a2060496ff5",
"body": "…n functionals (#6270)\n\n* Feature: add xcpnet_exch/corr_placeholder parameters to tune XC manually\n\n* Refactor: remove the xc_functional_libxc_id.cpp because it is not used\n\n* Change the default values of xcpnet_exch/corr_placeholder to those of pbe\n\n* change the name of keywords\n\n* update docs\n\n* c\n[…]\nap\n\n* remove unnecessary dependency on parameter.h\n\n* update the name of parameters and polish the note in docs\n\n* add assertion to avoid memory access ub\n\n* update doc\n\n* correct extended -> external",
"is_bot": false,
"headline": "Feature: universal customized parameterization on exchange-correlatio…",
"author_name": "kirk0830",
"author_login": "kirk0830",
"committed_at": "2025-06-13T05:27:28Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "3cad42496341e0377b2a56292a21aa83df182ff1",
"body": "* Combine some checking functions in DeePKS.\n\n* Remove check_f_delta().\n\n* Remove check_o_delta().\n\n* Update vdpre_ref.dat\n\n* Fix a bug.\n\n* Fix a merge bug.\n\n* Reduce the memory cost for DeePKS GO-UT.",
"is_bot": false,
"headline": "Refactor: Combine some checking functions in DeePKS. (#6285)",
"author_name": "Erjie Wu",
"author_login": "ErjieWu",
"committed_at": "2025-06-13T05:20:21Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "83aee57f58ab3f6508ffe008a1bed01eb7f19b1f",
"body": "…o (#6287)\n\n* Refactor: Move the code about calculation and output of ML KEDF descriptors to module_io\n\n* Refactor: Remove ml_data.h, ml_data.cpp, and ml_data_descriptor.cpp\n\n* Doc: Update the doc of of_ml_gene_data.",
"is_bot": false,
"headline": "Refactor: Migrate ML KEDF Descriptor Calculation & Output to module_i…",
"author_name": "Liang Sun",
"author_login": "sunliang98",
"committed_at": "2025-06-13T05:18:48Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "42042b4e31e298e707f1c29fb4306ea861d9ca28",
"body": "Co-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "add exx nscf file check (#6288)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-13T05:08:17Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "7155c3fa88cc83dc08352208c8bf79918c9b1d8a",
"body": "…6271)\n\n* replace ENABLE_DEEPKS & ENABLE_MLKEDF with ENABLE_ML4DFT\n\n* update doc\n\n* update doc\n\n* update ENABLE_MLALGO\n\n* solve some comments\n\n* update __DMLALGO\n\n* update __MLALGO\n\n* update cmakelists\n\n* update the meaning of machine learning algorithms\n\n---------\n\nCo-authored-by: Mohan Chen <mohanchen@pku.edu.cn>\nCo-authored-by: Liang Sun <50293369+sunliang98@users.noreply.github.com>",
"is_bot": false,
"headline": "Refactor: replace ENABLE_DEEPKS & ENABLE_MLKEDF with ENABLE_MLALGO (#…",
"author_name": "Haozhi Han",
"author_login": "haozhihan",
"committed_at": "2025-06-12T01:14:01Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "12acec28a09cd8a225f0dff3a218baa61cc828ee",
"body": null,
"is_bot": false,
"headline": "fix a bug (#6283)",
"author_name": "dzzz2001",
"author_login": "dzzz2001",
"committed_at": "2025-06-09T13:00:09Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "db9c16ca7c6e42b9bc1f9e2c97144734bd25f2c8",
"body": null,
"is_bot": false,
"headline": "Move DeePKS printing message from screen to log file. (#6281)",
"author_name": "Erjie Wu",
"author_login": "ErjieWu",
"committed_at": "2025-06-09T04:19:31Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "20142c8e0e727a21419fb2a71113ee563598e4e2",
"body": "…output filenames. Move some functions in 'after_all_runners' to 'after_scf'. Change 'out_dm' to 'out_dmk' and change 'out_dm1' to 'out_dmr' (#6278)\n\n* begin changing the output file names of out_mat_hs\n\n* update output vxc an output tk\n\n* Fix example 006_NO_GO_OH in 02_NAO_Gamma\n\n* fix a bug\n\n* fix\n[…]\nodes\n\n* update 031 032 103 104\n\n* update reference data for DOS\n\n* fix a bug in example 05_NO_KP_DJ_OC2\n\n* fix bug\n\n* update SDFT DOS\n\n* update dos ref\n\n* update DOS examples\n\n* update deepks examples",
"is_bot": false,
"headline": "Update the 'get_s' command and related description. Update the 'DOS' …",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-09T04:10:36Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "a05c14a024dfd4a26c87cd769bdef8951e6e818b",
"body": "…, enable a unified control of output information every few ionic steps. (#6272)\n\n* begin changing the output file names of out_mat_hs\n\n* update output vxc an output tk\n\n* Fix example 006_NO_GO_OH in 02_NAO_Gamma\n\n* fix a bug\n\n* fix 17_NO_KP_OH example in 03_NAO_multik\n\n* partly update the 19_NO_KP_\n[…]\nis before using ctrl_outut_lcao in lcao_after_scf\n\n* update\n\n* the functions turn normal, reconstruction finished\n\n* merge\n\n* fix bug related to deepks and exc\n\n* update input-main.md\n\n* fix exx codes",
"is_bot": false,
"headline": "Reconstruct the LCAO codes for the parameter 'PARAM.inp.out_interval'…",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-07T12:56:19Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "2b1e662b6014828a6a9a406aeab2f6ec197d00b1",
"body": "* change globalv\n\n* add dsp for the nonlocal_pw\n\n* modify basis name",
"is_bot": false,
"headline": "Add Mt_Gemm for the nonlocal_pw (#6253)",
"author_name": "liiutao",
"author_login": "A-006",
"committed_at": "2025-06-07T04:08:34Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "262be9e02d8374134bbeccd41fbafe036d6973f6",
"body": "* Test: Add version check workflow for release validation\n\n* Test: Update version_check.yml",
"is_bot": false,
"headline": "Test: Add version check workflow for release validation (#6273)",
"author_name": "Liang Sun",
"author_login": "sunliang98",
"committed_at": "2025-06-07T03:15:15Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "6dbaae8018e10ac5faa5a524e80a0253548cd936",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Bump version v3.9.0.7 (#6275)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-06-06T03:15:11Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "d3c9d0f08e909c3553598d2aff6d3e614045f15a",
"body": "… modify the filenames of H(R), S(R), T(R), and Vxc (#6262)\n\n* begin changing the output file names of out_mat_hs\n\n* update output vxc an output tk\n\n* Fix example 006_NO_GO_OH in 02_NAO_Gamma\n\n* fix a bug\n\n* fix 17_NO_KP_OH example in 03_NAO_multik\n\n* partly update the 19_NO_KP_OH_nscf exxample and \n[…]\nO_KP_OHS_S4\n\n* fix the example 20_NO_KP_OHS_S4\n\n* print out the information for H(R), S(R), H(k) and S(k)\n\n* update 08_EXX examples\n\n* update output filenames related to dH, dS, rR\n\n* update documents",
"is_bot": false,
"headline": "Update the output filenames of H(k), S(k), T(k) and Vxc. In addition,…",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-03T14:21:53Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "6654849f13a791c060c8f3f2d3b5c45e217c99fa",
"body": "* Feature: implement k continuity initialization strategy & kernel\noptimization in davidson-subspcae algorithm\n\n- add k continuity initialization strategy in planewave basis\n- implement heterogenous computation branching between CPU and DCU\n- implement optimized eigenvalue operations for GPU & DCU\n- implement optimized preconditioner for GPU & DCU\n- implement optimized normalization op for GPU & DCU\n\n* add tests & docs\n\n* fix brace error",
"is_bot": false,
"headline": "Feature: implement k continuity initialization strategy & kernel (#6171)",
"author_name": "Jie Li",
"author_login": "jieli-matrix",
"committed_at": "2025-06-03T09:27:20Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "025e574bc719857537764409e342c0f6d2e83dea",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Docs: EXX PW Documents (#6259)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-06-03T03:22:13Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "80ada9e406b9098e5a33226746ff70ddd02ccc33",
"body": "* feat pexsi\n\n* fix : diag not completed\n\n* feat\n\n* feat: pexsi hsolver\n\n* CMake building implemented\n\n* Works\n\n* adapt to the new container\n\n* Turn off USE_PEXSI\n\n* Update LibRI to 553c91c\n\n* modify include files\n\n* namespace-ize\n\n* new inputs added\n\n* Configure Makefile Compiling, fix typos\n\n* Fix\n[…]\n531+jingan-181@users.noreply.github.com>\nCo-authored-by: StarGrys <771582678@qq.com>\nCo-authored-by: Haozhi Han <haozhi.han@stu.pku.edu.cn>\nCo-authored-by: Mohan Chen <mohan.chen.chen.mohan@gmail.com>",
"is_bot": false,
"headline": "Feature: Spin-polarized calculations for EXX PW (#6260)",
"author_name": "Hongxu Ren",
"author_login": "Flying-dragon-boxing",
"committed_at": "2025-06-02T14:28:59Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "9cfa31f8fe6b5266318a408aab643333f26d9187",
"body": "… \"out_band\" (open files eigs1.txt and eigs2.txt). In the 'after_all_runners\" subroutine in SDFT, use after_all_runners from ESolver_KS (#6257)\n\n* add notes for the modified output file names, specify the names in the 3.10-LTS version\n\n* update the CHG file names in input-main.md and change the outp\n[…]\nng to eig.txt instead of the old istate.info\n\n* update write_istate_info.cpp\n\n* fix write_istate_info test\n\n* update the test read_wf2rho_pw_test.cpp\n\n* change the name of reference data eigs1.txt.ref",
"is_bot": false,
"headline": "Change 'istate.info' to 'eig.txt', add explanations for the parameter…",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-06-02T06:38:11Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "2d6accbf5a3f4b57f71c24e3935d0cf5041b68bd",
"body": "* add check and update code format in exx (#6244)\n\n* fix bug and update code format in exx\n\n* Fix bug in Exx_LRI_Interface. Change && to ||\n\n* update exx in ESolver_KS_LCAO and FORCE_STRESS\n\n* update runtime check in Exx_LRI_Interface\n\n* move exx_lri_double from ESolver_KS_LCAO to Exx_LRI_Interface\n\n[…]\n-\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>\nConflicts:\n\tsource/module_ri/Exx_LRI_interface.hpp\n\n* refactor RI_Util::get_ccp_parameter()\n\n---------\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "Exx ccp parameter (#6256)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-01T02:53:20Z",
"body_truncated": true,
"is_coding_agent": false
},
{
"oid": "9d78d905569bce85c963d0150e3cc7374f2a09c8",
"body": "* fix bug and update code format in exx\n\n* Fix bug in Exx_LRI_Interface. Change && to ||\n\n* update exx in ESolver_KS_LCAO and FORCE_STRESS\n\n* update runtime check in Exx_LRI_Interface\n\n* move exx_lri_double from ESolver_KS_LCAO to Exx_LRI_Interface\n\n---------\n\n\nConflicts:\n\tsource/module_ri/Exx_LRI_interface.hpp\n\nCo-authored-by: linpz <linpz@mail.ustc.edu.cn>",
"is_bot": false,
"headline": "add check and update code format in exx (#6244) (#6255)",
"author_name": "linpeize",
"author_login": "linpeize",
"committed_at": "2025-06-01T02:51:43Z",
"body_truncated": false,
"is_coding_agent": false
},
{
"oid": "9f3e6e72de43da16dd50435bf23cc99662633436",
"body": "…ensities (#6254)\n\n* add notes for the modified output file names, specify the names in the 3.10-LTS version\n\n* update the CHG file names in input-main.md and change the output file names of charge density\n\n* add explanations for taus1.cube, etc.\n\n* change the file names for 203_PW_OK example\n\n* upd\n[…]\n050_PW_CHG_mismatch\n\n* update the file names of charge densities\n\n* update CHG files in support directories\n\n* fix file names in rho_io_test.cpp\n\n* update 203_PW_OK\n\n* update result.ref in 23_NO_KP_OK",
"is_bot": false,
"headline": "Change the file names of output charge densities and kinetic energy d…",
"author_name": "Mohan Chen",
"author_login": "mohanchen",
"committed_at": "2025-05-31T14:49:40Z",
"body_truncated": true,
"is_coding_agent": false
}
],
"releases_count": 82,
"commits_last_year": 12,
"latest_release_at": "2025-11-24T10:13:57Z",
"latest_release_tag": "v3.9.0.19",
"releases_from_tags": false,
"days_since_last_push": 25,
"active_weeks_last_year": 2,
"days_since_latest_release": 239,
"mean_days_between_releases": 14
},
"community": {
"has_readme": true,
"has_license": true,
"has_description": true,
"has_contributing": true,
"health_percentage": 62,
"has_issue_template": false,
"has_code_of_conduct": false,
"has_pull_request_template": true
},
"ecosystem": {
"packages": [
{
"name": "pyabacus",
"exists": true,
"license": "GPL",
"keywords": [
"Development Status :: 5 - Production/Stable",
"License :: OSI Approved :: GNU General Public License (GPL)",
"Operating System :: OS Independent",
"Programming Language :: Python :: 3",
"Topic :: Utilities"
],
"ecosystem": "pypi",
"matches_repo": false,
"registry_url": "https://pypi.org/project/pyabacus/",
"is_deprecated": false,
"latest_version": "1.2.1",
"repository_url": "https://github.com/Tausand-dev/PyAbacus",
"versions_count": 5,
"total_downloads": null,
"dependents_count": null,
"deprecation_note": null,
"maintainers_count": null,
"monthly_downloads": null,
"first_published_at": "2018-06-20T14:28:10.483017Z",
"latest_published_at": "2024-06-11T17:39:23.875739Z",
"latest_version_yanked": null,
"days_since_latest_publish": 770
}
]
},
"popularity": {
"forks": 287,
"stars": 207,
"watchers": 12,
"fork_history": {
"days": [
{
"date": "2021-02-01",
"count": 1
},
{
"date": "2021-02-06",
"count": 1
},
{
"date": "2021-05-25",
"count": 1
},
{
"date": "2021-07-15",
"count": 1
},
{
"date": "2021-08-16",
"count": 1
},
{
"date": "2021-09-28",
"count": 1
},
{
"date": "2021-10-13",
"count": 1
},
{
"date": "2022-08-15",
"count": 1
},
{
"date": "2022-08-21",
"count": 1
},
{
"date": "2022-09-27",
"count": 1
},
{
"date": "2022-10-04",
"count": 1
},
{
"date": "2022-12-02",
"count": 1
},
{
"date": "2023-02-10",
"count": 1
},
{
"date": "2023-03-13",
"count": 1
},
{
"date": "2023-04-10",
"count": 1
},
{
"date": "2023-12-05",
"count": 1
},
{
"date": "2024-04-18",
"count": 1
},
{
"date": "2024-05-31",
"count": 1
},
{
"date": "2024-06-04",
"count": 1
},
{
"date": "2024-06-16",
"count": 1
},
{
"date": "2024-09-20",
"count": 2
},
{
"date": "2024-10-31",
"count": 1
},
{
"date": "2024-11-19",
"count": 1
},
{
"date": "2025-03-18",
"count": 1
},
{
"date": "2025-03-27",
"count": 1
},
{
"date": "2025-04-01",
"count": 1
},
{
"date": "2025-07-03",
"count": 1
},
{
"date": "2025-08-05",
"count": 1
},
{
"date": "2025-08-24",
"count": 1
},
{
"date": "2025-09-30",
"count": 1
},
{
"date": "2025-11-26",
"count": 1
},
{
"date": "2026-03-18",
"count": 1
},
{
"date": "2026-03-23",
"count": 1
},
{
"date": "2026-03-26",
"count": 1
},
{
"date": "2026-03-27",
"count": 1
},
{
"date": "2026-03-28",
"count": 1
},
{
"date": "2026-04-03",
"count": 1
},
{
"date": "2026-07-10",
"count": 1
}
],
"complete": true,
"collected": 39,
"total_forks": 287
},
"star_history": {
"days": [
{
"date": "2021-01-21",
"count": 1
},
{
"date": "2021-01-27",
"count": 1
},
{
"date": "2021-01-30",
"count": 1
},
{
"date": "2021-02-01",
"count": 2
},
{
"date": "2021-02-03",
"count": 1
},
{
"date": "2021-03-26",
"count": 4
},
{
"date": "2021-03-27",
"count": 1
},
{
"date": "2021-03-28",
"count": 1
},
{
"date": "2021-04-03",
"count": 1
},
{
"date": "2021-04-08",
"count": 1
},
{
"date": "2021-04-11",
"count": 1
},
{
"date": "2021-04-22",
"count": 1
},
{
"date": "2021-05-05",
"count": 1
},
{
"date": "2021-05-17",
"count": 1
},
{
"date": "2021-05-25",
"count": 1
},
{
"date": "2021-06-02",
"count": 1
},
{
"date": "2021-07-15",
"count": 1
},
{
"date": "2021-07-26",
"count": 1
},
{
"date": "2021-08-19",
"count": 1
},
{
"date": "2021-09-03",
"count": 1
},
{
"date": "2021-09-10",
"count": 1
},
{
"date": "2021-09-22",
"count": 1
},
{
"date": "2021-09-23",
"count": 2
},
{
"date": "2021-09-28",
"count": 2
},
{
"date": "2021-10-04",
"count": 1
},
{
"date": "2021-10-10",
"count": 1
},
{
"date": "2021-10-29",
"count": 1
},
{
"date": "2021-11-04",
"count": 1
},
{
"date": "2021-11-11",
"count": 1
},
{
"date": "2021-11-30",
"count": 1
},
{
"date": "2021-12-03",
"count": 1
},
{
"date": "2021-12-09",
"count": 1
},
{
"date": "2021-12-22",
"count": 1
},
{
"date": "2022-01-02",
"count": 1
},
{
"date": "2022-01-03",
"count": 1
},
{
"date": "2022-01-07",
"count": 1
},
{
"date": "2022-04-08",
"count": 1
},
{
"date": "2022-04-11",
"count": 1
},
{
"date": "2022-04-12",
"count": 1
},
{
"date": "2022-04-18",
"count": 1
},
{
"date": "2022-04-28",
"count": 1
},
{
"date": "2022-05-05",
"count": 1
},
{
"date": "2022-05-30",
"count": 1
},
{
"date": "2022-06-01",
"count": 1
},
{
"date": "2022-06-29",
"count": 1
},
{
"date": "2022-06-30",
"count": 1
},
{
"date": "2022-07-01",
"count": 1
},
{
"date": "2022-07-08",
"count": 1
},
{
"date": "2022-07-13",
"count": 1
},
{
"date": "2022-07-14",
"count": 1
},
{
"date": "2022-07-16",
"count": 1
},
{
"date": "2022-07-21",
"count": 2
},
{
"date": "2022-08-01",
"count": 2
},
{
"date": "2022-08-09",
"count": 2
},
{
"date": "2022-08-11",
"count": 1
},
{
"date": "2022-08-12",
"count": 1
},
{
"date": "2022-08-13",
"count": 1
},
{
"date": "2022-08-14",
"count": 1
},
{
"date": "2022-08-15",
"count": 1
},
{
"date": "2022-08-24",
"count": 1
},
{
"date": "2022-08-29",
"count": 1
},
{
"date": "2022-09-07",
"count": 1
},
{
"date": "2022-09-20",
"count": 1
},
{
"date": "2022-09-23",
"count": 2
},
{
"date": "2022-09-25",
"count": 1
},
{
"date": "2022-09-27",
"count": 1
},
{
"date": "2022-10-04",
"count": 1
},
{
"date": "2022-10-05",
"count": 1
},
{
"date": "2022-10-28",
"count": 1
},
{
"date": "2022-11-11",
"count": 1
},
{
"date": "2022-11-14",
"count": 1
},
{
"date": "2022-11-16",
"count": 1
},
{
"date": "2022-11-22",
"count": 1
},
{
"date": "2022-11-24",
"count": 2
},
{
"date": "2022-11-25",
"count": 1
},
{
"date": "2022-12-06",
"count": 1
},
{
"date": "2022-12-08",
"count": 1
},
{
"date": "2022-12-09",
"count": 1
},
{
"date": "2022-12-16",
"count": 1
},
{
"date": "2023-01-01",
"count": 1
},
{
"date": "2023-02-06",
"count": 1
},
{
"date": "2023-02-16",
"count": 1
},
{
"date": "2023-02-17",
"count": 1
},
{
"date": "2023-02-18",
"count": 1
},
{
"date": "2023-02-22",
"count": 1
},
{
"date": "2023-03-02",
"count": 1
},
{
"date": "2023-03-08",
"count": 1
},
{
"date": "2023-03-10",
"count": 2
},
{
"date": "2023-03-13",
"count": 1
},
{
"date": "2023-03-15",
"count": 1
},
{
"date": "2023-03-28",
"count": 1
},
{
"date": "2023-04-03",
"count": 1
},
{
"date": "2023-04-11",
"count": 2
},
{
"date": "2023-04-12",
"count": 2
},
{
"date": "2023-04-15",
"count": 1
},
{
"date": "2023-04-18",
"count": 1
},
{
"date": "2023-04-23",
"count": 2
},
{
"date": "2023-05-04",
"count": 1
},
{
"date": "2023-05-23",
"count": 1
},
{
"date": "2023-05-26",
"count": 1
},
{
"date": "2023-05-30",
"count": 1
},
{
"date": "2023-06-08",
"count": 1
},
{
"date": "2023-06-22",
"count": 1
},
{
"date": "2023-07-04",
"count": 1
},
{
"date": "2023-07-13",
"count": 1
},
{
"date": "2023-07-18",
"count": 1
},
{
"date": "2023-07-22",
"count": 1
},
{
"date": "2023-07-26",
"count": 1
},
{
"date": "2023-08-09",
"count": 1
},
{
"date": "2023-08-25",
"count": 1
},
{
"date": "2023-09-05",
"count": 1
},
{
"date": "2023-09-15",
"count": 1
},
{
"date": "2023-09-20",
"count": 1
},
{
"date": "2023-10-13",
"count": 1
},
{
"date": "2023-10-16",
"count": 1
},
{
"date": "2023-10-22",
"count": 1
},
{
"date": "2023-11-18",
"count": 1
},
{
"date": "2023-11-28",
"count": 1
},
{
"date": "2023-12-03",
"count": 1
},
{
"date": "2023-12-11",
"count": 1
},
{
"date": "2023-12-13",
"count": 1
},
{
"date": "2023-12-22",
"count": 1
},
{
"date": "2024-01-13",
"count": 1
},
{
"date": "2024-01-27",
"count": 1
},
{
"date": "2024-03-11",
"count": 1
},
{
"date": "2024-03-14",
"count": 1
},
{
"date": "2024-03-21",
"count": 1
},
{
"date": "2024-04-17",
"count": 1
},
{
"date": "2024-05-10",
"count": 1
},
{
"date": "2024-06-21",
"count": 1
},
{
"date": "2024-07-13",
"count": 1
},
{
"date": "2024-07-27",
"count": 1
},
{
"date": "2024-08-18",
"count": 1
},
{
"date": "2024-08-20",
"count": 2
},
{
"date": "2024-08-28",
"count": 2
},
{
"date": "2024-09-20",
"count": 1
},
{
"date": "2024-10-02",
"count": 1
},
{
"date": "2024-10-09",
"count": 1
},
{
"date": "2024-11-26",
"count": 1
},
{
"date": "2024-12-02",
"count": 1
},
{
"date": "2024-12-23",
"count": 1
},
{
"date": "2024-12-30",
"count": 1
},
{
"date": "2025-01-06",
"count": 1
},
{
"date": "2025-01-09",
"count": 1
},
{
"date": "2025-01-20",
"count": 1
},
{
"date": "2025-02-25",
"count": 1
},
{
"date": "2025-03-12",
"count": 1
},
{
"date": "2025-03-18",
"count": 1
},
{
"date": "2025-03-31",
"count": 1
},
{
"date": "2025-04-01",
"count": 1
},
{
"date": "2025-04-04",
"count": 1
},
{
"date": "2025-05-10",
"count": 1
},
{
"date": "2025-07-11",
"count": 1
},
{
"date": "2025-07-15",
"count": 1
},
{
"date": "2025-07-20",
"count": 1
},
{
"date": "2025-07-29",
"count": 1
},
{
"date": "2025-08-08",
"count": 1
},
{
"date": "2025-08-16",
"count": 1
},
{
"date": "2025-08-20",
"count": 1
},
{
"date": "2025-09-10",
"count": 1
},
{
"date": "2025-09-23",
"count": 1
},
{
"date": "2025-09-26",
"count": 1
},
{
"date": "2025-09-30",
"count": 1
},
{
"date": "2025-10-20",
"count": 1
},
{
"date": "2025-10-24",
"count": 1
},
{
"date": "2025-10-27",
"count": 1
},
{
"date": "2025-10-28",
"count": 1
},
{
"date": "2025-10-29",
"count": 1
},
{
"date": "2025-11-05",
"count": 1
},
{
"date": "2025-11-06",
"count": 1
},
{
"date": "2025-11-27",
"count": 1
},
{
"date": "2025-12-18",
"count": 1
},
{
"date": "2026-01-06",
"count": 1
},
{
"date": "2026-01-22",
"count": 1
},
{
"date": "2026-01-30",
"count": 1
},
{
"date": "2026-03-10",
"count": 1
},
{
"date": "2026-03-26",
"count": 1
},
{
"date": "2026-03-28",
"count": 1
},
{
"date": "2026-04-13",
"count": 1
},
{
"date": "2026-04-19",
"count": 1
},
{
"date": "2026-05-19",
"count": 1
},
{
"date": "2026-05-21",
"count": 1
},
{
"date": "2026-05-30",
"count": 1
},
{
"date": "2026-06-05",
"count": 1
},
{
"date": "2026-06-10",
"count": 1
},
{
"date": "2026-06-15",
"count": 1
},
{
"date": "2026-06-27",
"count": 1
},
{
"date": "2026-06-30",
"count": 1
},
{
"date": "2026-07-17",
"count": 1
},
{
"date": "2026-07-18",
"count": 1
}
],
"complete": true,
"collected": 207,
"total_stars": 207
},
"open_issues_and_prs": 9
},
"ai_readiness": {
"has_nix": false,
"example_dirs": [
"examples"
],
"has_llms_txt": false,
"has_dockerfile": true,
"has_mcp_signal": false,
"bootstrap_files": [
"docs/Makefile",
"python/pyabacus/noxfile.py",
"source/Makefile",
"source/source_basis/module_ao/1_Documents/sphinx/Makefile",
"source/source_basis/module_pw/test/Makefile",
"source/source_lcao/module_deepks/test/Makefile",
"source/source_pw/module_pwdft/Makefile",
"tools/SIAB/SimulatedAnnealing/backup_old_version/1_Source/Makefile",
"tools/SIAB/SimulatedAnnealing/source/Makefile"
],
"api_schema_files": [],
"has_devcontainer": true,
"typecheck_configs": [],
"toolchain_manifests": [],
"largest_source_bytes": 2185065,
"source_files_sampled": 2072,
"oversized_source_files": 15,
"agent_instruction_files": [],
"agent_instruction_max_bytes": null
},
"dependencies": {
"manifests": [
"docs/requirements.txt"
],
"advisories": {
"error": null,
"scope": "published_package",
"source": "osv",
"findings": [],
"collected": true,
"malicious": [],
"truncated": false,
"by_severity": {},
"advisory_count": 0,
"affected_count": 0,
"assessed_count": 1,
"malicious_count": 0,
"assessed_package": "pypi:pyabacus@1.2.1",
"unassessed_count": 0,
"direct_affected_count": 0
},
"ecosystems": [
"pypi"
],
"dependencies": [],
"all_dependencies": {
"error": null,
"source": "github-sbom",
"packages": [
{
"name": "breathe",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "deepmodeling-sphinx",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "exhale",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "lxml",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "matplotlib",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "myst-parser",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "numpy",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "setuptools",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "sphinx",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "sphinx-book-theme",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "sphinx-rtd-theme",
"direct": false,
"version": null,
"ecosystem": "pypi"
},
{
"name": "urllib3",
"direct": false,
"version": null,
"ecosystem": "pypi"
}
],
"collected": true,
"truncated": false,
"total_count": 12,
"direct_count": 0,
"indirect_count": 12
}
},
"maintainership": {
"issues": {
"open_prs": 3,
"merged_prs": 163,
"open_issues": 6,
"closed_ratio": 0.939,
"closed_issues": 93,
"closed_unmerged_prs": 110
},
"bus_factor": 6,
"bot_contributors": 1,
"top_contributors": [
{
"type": "User",
"login": "dyzheng",
"commits": 931,
"avatar_url": "https://avatars.githubusercontent.com/u/49852742?v=4"
},
{
"type": "User",
"login": "Qianruipku",
"commits": 577,
"avatar_url": "https://avatars.githubusercontent.com/u/76200646?v=4"
},
{
"type": "User",
"login": "caic99",
"commits": 539,
"avatar_url": "https://avatars.githubusercontent.com/u/78061359?v=4"
},
{
"type": "User",
"login": "mohanchen",
"commits": 504,
"avatar_url": "https://avatars.githubusercontent.com/u/14967846?v=4"
},
{
"type": "User",
"login": "YuLiu98",
"commits": 450,
"avatar_url": "https://avatars.githubusercontent.com/u/77716030?v=4"
},
{
"type": "User",
"login": "hongriTianqi",
"commits": 412,
"avatar_url": "https://avatars.githubusercontent.com/u/18049272?v=4"
},
{
"type": "User",
"login": "wenfei-li",
"commits": 390,
"avatar_url": "https://avatars.githubusercontent.com/u/38569667?v=4"
},
{
"type": "User",
"login": "maki49",
"commits": 378,
"avatar_url": "https://avatars.githubusercontent.com/u/33978601?v=4"
},
{
"type": "User",
"login": "pxlxingliang",
"commits": 283,
"avatar_url": "https://avatars.githubusercontent.com/u/91927439?v=4"
},
{
"type": "User",
"login": "PeizeLin",
"commits": 263,
"avatar_url": "https://avatars.githubusercontent.com/u/78645006?v=4"
}
],
"contributors_sampled": 99,
"top_contributor_share": 0.139
},
"quality_signals": {
"has_ci": true,
"has_tests": true,
"ci_workflows": [
"build_test_cmake.yml",
"build_test_makefile.yml",
"coverage.yml",
"cuda.yml",
"devcontainer.yml",
"doxygen.yml",
"dynamic.yml",
"mirror_gitee.yml",
"performance.yml",
"pytest.yml",
"test.yml",
"version_check.yml"
],
"has_docs_dir": true,
"linter_configs": [],
"has_editorconfig": true,
"has_linter_config": true,
"has_precommit_config": true
},
"security_signals": {
"lockfiles": [],
"scorecard": {
"checks": [
{
"name": "Binary-Artifacts",
"score": 10,
"reason": "no binaries found in the repo",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#binary-artifacts"
},
{
"name": "Branch-Protection",
"score": 0,
"reason": "branch protection not enabled on development/release branches",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#branch-protection"
},
{
"name": "CI-Tests",
"score": null,
"reason": "no pull request found",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#ci-tests"
},
{
"name": "CII-Best-Practices",
"score": 0,
"reason": "no effort to earn an OpenSSF best practices badge detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#cii-best-practices"
},
{
"name": "Code-Review",
"score": 0,
"reason": "Found 0/30 approved changesets -- score normalized to 0",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#code-review"
},
{
"name": "Contributors",
"score": 10,
"reason": "project has 12 contributing companies or organizations",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#contributors"
},
{
"name": "Dangerous-Workflow",
"score": 10,
"reason": "no dangerous workflow patterns detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#dangerous-workflow"
},
{
"name": "Dependency-Update-Tool",
"score": 10,
"reason": "update tool detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#dependency-update-tool"
},
{
"name": "Fuzzing",
"score": 0,
"reason": "project is not fuzzed",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#fuzzing"
},
{
"name": "License",
"score": 10,
"reason": "license file detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#license"
},
{
"name": "Maintained",
"score": 0,
"reason": "0 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 0",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#maintained"
},
{
"name": "Packaging",
"score": null,
"reason": "packaging workflow not detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#packaging"
},
{
"name": "Pinned-Dependencies",
"score": 0,
"reason": "dependency not pinned by hash detected -- score normalized to 0",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#pinned-dependencies"
},
{
"name": "SAST",
"score": 0,
"reason": "no SAST tool detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#sast"
},
{
"name": "Security-Policy",
"score": 0,
"reason": "security policy file not detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#security-policy"
},
{
"name": "Signed-Releases",
"score": null,
"reason": "no releases found",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#signed-releases"
},
{
"name": "Token-Permissions",
"score": 0,
"reason": "detected GitHub workflow tokens with excessive permissions",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#token-permissions"
},
{
"name": "Vulnerabilities",
"score": 10,
"reason": "0 existing vulnerabilities detected",
"documentation_url": "https://github.com/ossf/scorecard/blob/c395761df6afe1a69e476bc60a013a94bcbc153f/docs/checks.md#vulnerabilities"
}
],
"commit": "2f59a6fcfc787a024694201c77ccfe8549c80193",
"ran_at": "2026-07-21T23:17:41Z",
"aggregate_score": 4.2,
"scorecard_version": "v5.5.0"
},
"has_codeql_workflow": false,
"has_security_policy": false,
"has_dependabot_config": true
},
"contribution_flow": {
"collected": true,
"ci_last_run_at": "2026-07-19T16:43:21Z",
"oldest_open_prs": [
{
"number": 361,
"created_at": "2026-03-28T06:39:58Z",
"last_comment_at": null,
"last_comment_author": null
},
{
"number": 364,
"created_at": "2026-04-06T07:59:39Z",
"last_comment_at": null,
"last_comment_author": null
},
{
"number": 371,
"created_at": "2026-06-07T07:04:32Z",
"last_comment_at": null,
"last_comment_author": null
}
],
"last_merged_pr_at": "2025-06-09T09:40:34Z",
"ci_last_conclusion": "SKIPPED",
"oldest_open_issues": [
{
"number": 274,
"created_at": "2023-04-26T04:00:58Z",
"last_comment_at": null,
"last_comment_author": null
},
{
"number": 276,
"created_at": "2023-05-08T08:29:18Z",
"last_comment_at": null,
"last_comment_author": null
},
{
"number": 334,
"created_at": "2024-09-26T08:53:58Z",
"last_comment_at": "2024-09-26T08:58:24Z",
"last_comment_author": "kirk0830"
},
{
"number": 350,
"created_at": "2026-01-12T13:57:53Z",
"last_comment_at": "2026-01-12T14:00:07Z",
"last_comment_author": "runoobworker"
},
{
"number": 352,
"created_at": "2026-02-10T17:17:20Z",
"last_comment_at": null,
"last_comment_author": null
},
{
"number": 366,
"created_at": "2026-05-06T07:45:51Z",
"last_comment_at": null,
"last_comment_author": null
}
]
}
},
"config": {
"disabled_metrics": [],
"disabled_categories": [],
"disabled_components": {}
},
"source": {
"url": "https://github.com/abacusmodeling/abacus-develop",
"host": "github.com",
"name": "abacus-develop",
"owner": "abacusmodeling"
},
"metrics": {
"overall": {
"key": "overall",
"band": "moderate",
"name": "Overall health",
"note": null,
"notes": [],
"value": 69,
"inputs": {
"security": 54,
"vitality": 55,
"community": 70,
"governance": 74,
"engineering": 90
},
"components": []
},
"categories": [
{
"key": "vitality",
"band": "moderate",
"name": "Vitality",
"value": 55,
"weight": 0.22,
"metrics": [
{
"key": "development_activity",
"band": "at_risk",
"name": "Development activity",
"note": null,
"notes": [],
"value": 40,
"inputs": {
"commits_last_year": 12,
"human_commit_share": 1,
"days_since_last_push": 25,
"active_weeks_last_year": 2
},
"components": [
{
"key": "push_recency",
"name": "Push recency",
"detail": "last push 25 days ago",
"points": 28.8,
"status": "partial",
"details": [
{
"code": "push_recency",
"params": {
"days": 25
}
}
],
"max_points": 36
},
{
"key": "commit_cadence",
"name": "Commit cadence",
"detail": "2/52 weeks with commits",
"points": 1.4,
"status": "partial",
"details": [
{
"code": "commit_cadence_weeks",
"params": {
"weeks": 2
}
}
],
"max_points": 36
},
{
"key": "commit_volume",
"name": "Commit volume",
"detail": "12 commits in the last year",
"points": 10,
"status": "partial",
"details": [
{
"code": "commits_last_year",
"params": {
"count": 12
}
}
],
"max_points": 18
},
{
"key": "openssf_scorecard_maintained",
"name": "OpenSSF Scorecard: Maintained",
"detail": "0 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 10
}
]
},
{
"key": "release_discipline",
"band": "good",
"name": "Release discipline",
"note": "Excluded from scoring (no data or not applicable): OpenSSF Scorecard: Signed-Releases. Remaining weights renormalized.",
"notes": [
{
"code": "excluded_no_data",
"params": {
"components": [
"openssf_scorecard_signed_releases"
]
}
},
{
"code": "weights_renormalized",
"params": {}
}
],
"value": 78,
"inputs": {
"releases_count": 82,
"latest_release_tag": "v3.9.0.19",
"releases_from_tags": false,
"days_since_latest_release": 239,
"mean_days_between_releases": 14
},
"components": [
{
"key": "ships_releases",
"name": "Ships releases",
"detail": "82 releases published",
"points": 27,
"status": "met",
"details": [
{
"code": "releases_published",
"params": {
"count": 82
}
}
],
"max_points": 27
},
{
"key": "release_recency",
"name": "Release recency",
"detail": "latest release 239 days ago",
"points": 16.2,
"status": "partial",
"details": [
{
"code": "release_recency",
"params": {
"days": 239
}
}
],
"max_points": 36
},
{
"key": "release_cadence",
"name": "Release cadence",
"detail": "a release every ~14 days",
"points": 27,
"status": "met",
"details": [
{
"code": "release_cadence",
"params": {
"gap": 14
}
}
],
"max_points": 27
},
{
"key": "openssf_scorecard_signed_releases",
"name": "OpenSSF Scorecard: Signed-Releases",
"detail": "no releases found",
"points": 0,
"status": "excluded",
"details": [
{
"code": "no_data",
"params": {}
}
],
"max_points": 10
}
]
},
{
"key": "abandonment",
"band": "excellent",
"name": "Abandonment",
"note": null,
"notes": [],
"value": 100,
"inputs": {
"cap": null,
"state": "dormant",
"guards": [
"recent_release",
"dependencies_clean"
],
"signals": [
"scorecard_unmaintained"
],
"red_flag": false,
"multiplier_pct": 100,
"declared_reason": null,
"unverified_reason": null,
"unanswered_open_prs": 0,
"unanswered_open_issues": 3,
"days_since_last_merged_pr": 407,
"days_since_last_human_commit": 351,
"days_since_last_human_commit_is_floor": false
},
"components": [
{
"key": "project_is_still_maintained",
"name": "Project is still maintained",
"detail": "no human commit for 351 days, with nothing left unanswered; held at dormant by a release within the year, no affected dependency",
"points": 100,
"status": "met",
"details": [
{
"code": "abandonment_quiet",
"params": {
"days": 351
}
},
{
"code": "abandonment_guarded",
"params": {
"guards": "a release within the year, no affected dependency"
}
}
],
"max_points": 100
}
]
}
],
"description": "Is the project alive — is code being written and are releases shipping?"
},
{
"key": "community",
"band": "good",
"name": "Community & Adoption",
"value": 70,
"weight": 0.18,
"metrics": [
{
"key": "popularity",
"band": "moderate",
"name": "Popularity & adoption",
"note": null,
"notes": [],
"value": 64,
"inputs": {
"forks": 287,
"stars": 207,
"watchers": 12,
"growth_state": "organic",
"growth_factor_pct": 100
},
"components": [
{
"key": "stars",
"name": "Stars",
"detail": "207 stars",
"points": 37.5,
"status": "partial",
"details": [
{
"code": "stars",
"params": {
"count": 207
}
}
],
"max_points": 60
},
{
"key": "forks",
"name": "Forks",
"detail": "287 forks",
"points": 20.5,
"status": "partial",
"details": [
{
"code": "forks",
"params": {
"count": 287
}
}
],
"max_points": 25
},
{
"key": "watchers",
"name": "Watchers",
"detail": "12 watchers",
"points": 5.8,
"status": "partial",
"details": [
{
"code": "watchers",
"params": {
"count": 12
}
}
],
"max_points": 15
}
]
},
{
"key": "community_health",
"band": "good",
"name": "Community health",
"note": null,
"notes": [],
"value": 77,
"inputs": {
"has_readme": true,
"has_license": true,
"has_contributing": true,
"has_issue_template": false,
"has_code_of_conduct": false,
"has_pull_request_template": true
},
"components": [
{
"key": "readme",
"name": "README",
"detail": null,
"points": 22.5,
"status": "met",
"details": [],
"max_points": 22.5
},
{
"key": "license",
"name": "License",
"detail": "recognized license (LGPL-3.0)",
"points": 22.5,
"status": "met",
"details": [
{
"code": "license_standard",
"params": {}
},
{
"code": "license_spdx",
"params": {
"spdx": "LGPL-3.0"
}
}
],
"max_points": 22.5
},
{
"key": "contributing_guide",
"name": "CONTRIBUTING guide",
"detail": null,
"points": 18,
"status": "met",
"details": [],
"max_points": 18
},
{
"key": "code_of_conduct",
"name": "Code of conduct",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 13.5
},
{
"key": "issue_template",
"name": "Issue template",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 7.2
},
{
"key": "pr_template",
"name": "PR template",
"detail": null,
"points": 6.3,
"status": "met",
"details": [],
"max_points": 6.3
}
]
}
],
"description": "Does the project have users, downloads, attention, and a welcoming setup for contributors?"
},
{
"key": "governance",
"band": "good",
"name": "Sustainability & Governance",
"value": 74,
"weight": 0.24,
"metrics": [
{
"key": "maintainer_resilience",
"band": "excellent",
"name": "Maintainer resilience (bus factor)",
"note": null,
"notes": [],
"value": 92,
"inputs": {
"bus_factor": 6,
"contributors_sampled": 99,
"top_contributor_share": 0.139
},
"components": [
{
"key": "bus_factor",
"name": "Bus factor",
"detail": "6 contributor(s) cover half of all commits",
"points": 48.6,
"status": "partial",
"details": [
{
"code": "bus_factor",
"params": {
"count": 6
}
}
],
"max_points": 54
},
{
"key": "commit_distribution",
"name": "Commit distribution",
"detail": "top contributor authored 14% of commits",
"points": 19.4,
"status": "partial",
"details": [
{
"code": "top_contributor_share",
"params": {
"share": 14
}
}
],
"max_points": 22.5
},
{
"key": "contributor_breadth",
"name": "Contributor breadth",
"detail": "99 contributors",
"points": 13.5,
"status": "met",
"details": [
{
"code": "contributors_sampled",
"params": {
"count": 99
}
}
],
"max_points": 13.5
},
{
"key": "openssf_scorecard_contributors",
"name": "OpenSSF Scorecard: Contributors",
"detail": "project has 12 contributing companies or organizations",
"points": 10,
"status": "met",
"details": [],
"max_points": 10
}
]
},
{
"key": "responsiveness",
"band": "moderate",
"name": "Issue & PR responsiveness",
"note": null,
"notes": [],
"value": 67,
"inputs": {
"merged_prs": 163,
"open_issues": 6,
"closed_issues": 93,
"issue_closed_ratio": 0.939,
"closed_unmerged_prs": 110
},
"components": [
{
"key": "issue_resolution",
"name": "Issue resolution",
"detail": "94% of issues closed",
"points": 43.9,
"status": "partial",
"details": [
{
"code": "issues_closed_share",
"params": {
"share": 94
}
}
],
"max_points": 46.75
},
{
"key": "pr_acceptance",
"name": "PR acceptance",
"detail": "163/273 decided PRs merged",
"points": 22.8,
"status": "partial",
"details": [
{
"code": "decided_prs_merged",
"params": {
"merged": 163,
"decided": 273
}
}
],
"max_points": 38.25
},
{
"key": "openssf_scorecard_code_review",
"name": "OpenSSF Scorecard: Code-Review",
"detail": "Found 0/30 approved changesets -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 15
}
]
},
{
"key": "stewardship",
"band": "moderate",
"name": "Ownership & stewardship",
"note": null,
"notes": [],
"value": 61,
"inputs": {
"followers": 35,
"owner_type": "Organization",
"is_verified": null,
"owner_login": "abacusmodeling",
"public_repos": 17,
"account_age_days": 2008
},
"components": [
{
"key": "ownership_backing",
"name": "Ownership backing",
"detail": "organization-owned",
"points": 30,
"status": "met",
"details": [
{
"code": "owner_organization",
"params": {}
}
],
"max_points": 30
},
{
"key": "verified_domain",
"name": "Verified domain",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 20
},
{
"key": "owner_reach",
"name": "Owner reach",
"detail": "35 followers of abacusmodeling",
"points": 11.2,
"status": "partial",
"details": [
{
"code": "owner_followers",
"params": {
"count": 35,
"login": "abacusmodeling"
}
}
],
"max_points": 25
},
{
"key": "track_record",
"name": "Track record",
"detail": "17 public repos, account ~5 yr old",
"points": 20.1,
"status": "partial",
"details": [
{
"code": "public_repos",
"params": {
"count": 17
}
},
{
"code": "account_age_years",
"params": {
"years": 5
}
}
],
"max_points": 25
}
]
}
],
"description": "Will the project survive its people — bus factor, responsiveness, who backs it, and package upkeep?"
},
{
"key": "engineering",
"band": "excellent",
"name": "Engineering Quality",
"value": 90,
"weight": 0.2,
"metrics": [
{
"key": "engineering_practices",
"band": "excellent",
"name": "Engineering practices",
"note": "Excluded from scoring (no data or not applicable): OpenSSF Scorecard: CI-Tests. Remaining weights renormalized.",
"notes": [
{
"code": "excluded_no_data",
"params": {
"components": [
"openssf_scorecard_ci_tests"
]
}
},
{
"code": "weights_renormalized",
"params": {}
}
],
"value": 100,
"inputs": {
"has_ci": true,
"has_tests": true,
"has_editorconfig": true,
"has_linter_config": true,
"has_precommit_config": true
},
"components": [
{
"key": "ci_workflows",
"name": "CI workflows",
"detail": "12 workflow(s)",
"points": 24,
"status": "met",
"details": [
{
"code": "ci_workflows",
"params": {
"count": 12
}
}
],
"max_points": 24
},
{
"key": "tests_present",
"name": "Tests present",
"detail": null,
"points": 24,
"status": "met",
"details": [],
"max_points": 24
},
{
"key": "linter_config",
"name": "Linter config",
"detail": null,
"points": 16,
"status": "met",
"details": [],
"max_points": 16
},
{
"key": "pre_commit_hooks",
"name": "Pre-commit hooks",
"detail": null,
"points": 9.6,
"status": "met",
"details": [],
"max_points": 9.6
},
{
"key": "editorconfig",
"name": ".editorconfig",
"detail": null,
"points": 6.4,
"status": "met",
"details": [],
"max_points": 6.4
},
{
"key": "openssf_scorecard_ci_tests",
"name": "OpenSSF Scorecard: CI-Tests",
"detail": "no pull request found",
"points": 0,
"status": "excluded",
"details": [
{
"code": "no_data",
"params": {}
}
],
"max_points": 20
}
]
},
{
"key": "documentation",
"band": "good",
"name": "Documentation",
"note": null,
"notes": [],
"value": 75,
"inputs": {
"topics": [],
"has_wiki": true,
"homepage": null,
"has_readme": true,
"has_docs_dir": true,
"has_description": true
},
"components": [
{
"key": "readme",
"name": "README",
"detail": null,
"points": 30,
"status": "met",
"details": [],
"max_points": 30
},
{
"key": "documentation_directory",
"name": "Documentation directory",
"detail": null,
"points": 25,
"status": "met",
"details": [],
"max_points": 25
},
{
"key": "documentation_homepage_site",
"name": "Documentation / homepage site",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 15
},
{
"key": "repository_description",
"name": "Repository description",
"detail": null,
"points": 10,
"status": "met",
"details": [],
"max_points": 10
},
{
"key": "topics",
"name": "Topics",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 10
},
{
"key": "wiki",
"name": "Wiki",
"detail": null,
"points": 10,
"status": "met",
"details": [],
"max_points": 10
}
]
}
],
"description": "Are baseline engineering and documentation practices in place?"
},
{
"key": "security",
"band": "moderate",
"name": "Security",
"value": 54,
"weight": 0.16,
"metrics": [
{
"key": "security_posture",
"band": "at_risk",
"name": "Security posture",
"note": "Excluded from scoring (no data or not applicable): CI-Tests, Packaging, Signed-Releases. Remaining weights renormalized.",
"notes": [
{
"code": "excluded_no_data",
"params": {
"components": [
"ci_tests",
"packaging",
"signed_releases"
]
}
},
{
"code": "weights_renormalized",
"params": {}
}
],
"value": 42,
"inputs": {
"source": "openssf_scorecard",
"checks_evaluated": 15,
"scorecard_version": "v5.5.0",
"checks_inconclusive": 3,
"scorecard_aggregate": 4.2
},
"components": [
{
"key": "binary_artifacts",
"name": "Binary-Artifacts",
"detail": "no binaries found in the repo",
"points": 7.5,
"status": "met",
"details": [],
"max_points": 7.5
},
{
"key": "branch_protection",
"name": "Branch-Protection",
"detail": "branch protection not enabled on development/release branches",
"points": 0,
"status": "missed",
"details": [],
"max_points": 7.5
},
{
"key": "ci_tests",
"name": "CI-Tests",
"detail": "no pull request found",
"points": 0,
"status": "excluded",
"details": [
{
"code": "no_data",
"params": {}
}
],
"max_points": 2.5
},
{
"key": "cii_best_practices",
"name": "CII-Best-Practices",
"detail": "no effort to earn an OpenSSF best practices badge detected",
"points": 0,
"status": "missed",
"details": [],
"max_points": 2.5
},
{
"key": "code_review",
"name": "Code-Review",
"detail": "Found 0/30 approved changesets -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 7.5
},
{
"key": "contributors",
"name": "Contributors",
"detail": "project has 12 contributing companies or organizations",
"points": 2.5,
"status": "met",
"details": [],
"max_points": 2.5
},
{
"key": "dangerous_workflow",
"name": "Dangerous-Workflow",
"detail": "no dangerous workflow patterns detected",
"points": 10,
"status": "met",
"details": [],
"max_points": 10
},
{
"key": "dependency_update_tool",
"name": "Dependency-Update-Tool",
"detail": "update tool detected",
"points": 7.5,
"status": "met",
"details": [],
"max_points": 7.5
},
{
"key": "fuzzing",
"name": "Fuzzing",
"detail": "project is not fuzzed",
"points": 0,
"status": "missed",
"details": [],
"max_points": 5
},
{
"key": "license",
"name": "License",
"detail": "license file detected",
"points": 2.5,
"status": "met",
"details": [],
"max_points": 2.5
},
{
"key": "maintained",
"name": "Maintained",
"detail": "0 commit(s) and 0 issue activity found in the last 90 days -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 7.5
},
{
"key": "packaging",
"name": "Packaging",
"detail": "packaging workflow not detected",
"points": 0,
"status": "excluded",
"details": [
{
"code": "no_data",
"params": {}
}
],
"max_points": 5
},
{
"key": "pinned_dependencies",
"name": "Pinned-Dependencies",
"detail": "dependency not pinned by hash detected -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 5
},
{
"key": "sast",
"name": "SAST",
"detail": "no SAST tool detected",
"points": 0,
"status": "missed",
"details": [],
"max_points": 5
},
{
"key": "security_policy",
"name": "Security-Policy",
"detail": "security policy file not detected",
"points": 0,
"status": "missed",
"details": [],
"max_points": 5
},
{
"key": "signed_releases",
"name": "Signed-Releases",
"detail": "no releases found",
"points": 0,
"status": "excluded",
"details": [
{
"code": "no_data",
"params": {}
}
],
"max_points": 7.5
},
{
"key": "token_permissions",
"name": "Token-Permissions",
"detail": "detected GitHub workflow tokens with excessive permissions",
"points": 0,
"status": "missed",
"details": [],
"max_points": 7.5
},
{
"key": "vulnerabilities",
"name": "Vulnerabilities",
"detail": "0 existing vulnerabilities detected",
"points": 7.5,
"status": "met",
"details": [],
"max_points": 7.5
}
]
},
{
"key": "dependency_advisories",
"band": "excellent",
"name": "Dependency advisories",
"note": "Excluded from scoring (no data or not applicable): No advisories left outstanding. Remaining weights renormalized. Matched the pypi:pyabacus@1.2.1 runtime dependency closure — what installing the published package pulls in — 1 packages. Reachability is not analyzed.",
"notes": [
{
"code": "excluded_no_data",
"params": {
"components": [
"no_advisories_left_outstanding"
]
}
},
{
"code": "weights_renormalized",
"params": {}
},
{
"code": "advisories_scope_published",
"params": {
"package": "pypi:pyabacus@1.2.1",
"assessed": 1
}
},
{
"code": "advisories_reachability",
"params": {}
}
],
"value": 100,
"inputs": {
"source": "osv",
"advisories": 0,
"affected_packages": 0,
"assessed_packages": 1,
"unassessed_packages": 0,
"affected_by_severity": "none",
"direct_affected_packages": 0
},
"components": [
{
"key": "direct_dependencies_free_of_known_advisories",
"name": "Direct dependencies free of known advisories",
"detail": "no direct dependency carries a known advisory",
"points": 35,
"status": "met",
"details": [
{
"code": "no_direct_advisories",
"params": {}
}
],
"max_points": 35
},
{
"key": "indirect_dependencies_free_of_known_advisories",
"name": "Indirect dependencies free of known advisories",
"detail": "no indirect dependency carries a known advisory",
"points": 25,
"status": "met",
"details": [
{
"code": "no_indirect_advisories",
"params": {}
}
],
"max_points": 25
},
{
"key": "no_advisories_left_outstanding",
"name": "No advisories left outstanding",
"detail": "no advisory carries a publication date",
"points": 0,
"status": "excluded",
"details": [
{
"code": "advisories_no_publication_date",
"params": {}
}
],
"max_points": 40
}
]
},
{
"key": "malicious_dependencies",
"band": "excellent",
"name": "Malicious dependencies",
"note": null,
"notes": [],
"value": 100,
"inputs": {
"source": "osv",
"meaning": "reported as a malicious package by the OpenSSF corpus; the remedy is removal or moving off the compromised name, never an upgrade of the same artifact. Versions the registry has since pulled are listed but not scored",
"packages": [],
"red_flag": false,
"assessed_packages": 1,
"malicious_packages": 0,
"direct_malicious_packages": 0,
"withdrawn_malicious_packages": 0,
"installable_malicious_packages": 0
},
"components": [
{
"key": "no_dependency_reported_as_a_malicious_package",
"name": "No dependency reported as a malicious package",
"detail": "no dependency is reported as a malicious package",
"points": 100,
"status": "met",
"details": [
{
"code": "no_malicious_dependencies",
"params": {}
}
],
"max_points": 100
}
]
},
{
"key": "high_risk_jurisdiction_exposure",
"band": "excellent",
"name": "High-Risk Jurisdiction Exposure",
"note": "Only high-confidence self-published location evidence affects this multiplier. Ambiguous matches are review-only; country evidence is not proof of nationality, citizenship, legal registration, malicious intent, or sanctions status.",
"notes": [
{
"code": "jurisdiction_evidence_limits",
"params": {}
}
],
"value": 100,
"inputs": {
"meaning": "self-published location evidence; not nationality or citizenship",
"red_flag": false,
"exposures": [],
"policy_countries": [
"Russia",
"Iran",
"North Korea"
],
"review_only_matches": 0,
"assessed_self_published_locations": 3
},
"components": [
{
"key": "policy_exposure_multiplier",
"name": "Policy exposure multiplier",
"detail": "no confirmed policy-scope location match",
"points": 100,
"status": "met",
"details": [
{
"code": "jurisdiction_no_match",
"params": {}
}
],
"max_points": 100
}
]
}
],
"description": "Are visible security and supply-chain practices strong, with no malicious dependency and no unresolved high-risk jurisdiction exposure?"
},
{
"key": "ai_readiness",
"band": "moderate",
"name": "AI Readiness",
"value": 64,
"weight": 0,
"metrics": [
{
"key": "ai_agent_context",
"band": "at_risk",
"name": "Agent context & guidance",
"note": null,
"notes": [],
"value": 40,
"inputs": {
"has_llms_txt": false,
"legible_history_share": 0.97,
"agent_instruction_files": [],
"agent_instruction_max_bytes": null
},
"components": [
{
"key": "agent_instructions",
"name": "Agent instructions",
"detail": "no CLAUDE.md / AGENTS.md / editor rules",
"points": 0,
"status": "missed",
"details": [
{
"code": "no_agent_instructions",
"params": {}
}
],
"max_points": 45
},
{
"key": "machine_readable_docs_llms_txt",
"name": "Machine-readable docs (llms.txt)",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 15
},
{
"key": "legible_commit_history",
"name": "Legible commit history",
"detail": "97 of 100 human commits state their intent (structured subject or explanatory body)",
"points": 40,
"status": "met",
"details": [
{
"code": "legible_history",
"params": {
"legible": 97,
"sampled": 100
}
}
],
"max_points": 40
}
]
},
{
"key": "ai_verify_loop",
"band": "good",
"name": "Verify loop (build / test / typecheck)",
"note": null,
"notes": [],
"value": 77,
"inputs": {
"has_nix": false,
"has_tests": true,
"lockfiles": [],
"has_dockerfile": true,
"typed_language": true,
"bootstrap_files": [
"docs/Makefile",
"python/pyabacus/noxfile.py",
"source/Makefile",
"source/source_basis/module_ao/1_Documents/sphinx/Makefile",
"source/source_basis/module_pw/test/Makefile",
"source/source_lcao/module_deepks/test/Makefile",
"source/source_pw/module_pwdft/Makefile",
"tools/SIAB/SimulatedAnnealing/backup_old_version/1_Source/Makefile",
"tools/SIAB/SimulatedAnnealing/source/Makefile"
],
"has_devcontainer": true,
"has_linter_config": true,
"typecheck_configs": [],
"agent_commit_share": 0,
"toolchain_manifests": [],
"dependency_bot_commit_share": 0
},
"components": [
{
"key": "one_command_bootstrap",
"name": "One-command bootstrap",
"detail": "docs/Makefile, python/pyabacus/noxfile.py, source/Makefile, source/source_basis/module_ao/1_Documents/sphinx/Makefile, source/source_basis/module_pw/test/Makefile, source/source_lcao/module_deepks/test/Makefile, source/source_pw/module_pwdft/Makefile, tools/SIAB/SimulatedAnnealing/backup_old_version/1_Source/Makefile, tools/SIAB/SimulatedAnnealing/source/Makefile",
"points": 18,
"status": "met",
"details": [
{
"code": "file_list",
"params": {
"files": "docs/Makefile, python/pyabacus/noxfile.py, source/Makefile, source/source_basis/module_ao/1_Documents/sphinx/Makefile, source/source_basis/module_pw/test/Makefile, source/source_lcao/module_deepks/test/Makefile, source/source_pw/module_pwdft/Makefile, tools/SIAB/SimulatedAnnealing/backup_old_version/1_Source/Makefile, tools/SIAB/SimulatedAnnealing/source/Makefile"
}
}
],
"max_points": 18
},
{
"key": "automated_tests",
"name": "Automated tests",
"detail": null,
"points": 22,
"status": "met",
"details": [],
"max_points": 22
},
{
"key": "lint_format_config",
"name": "Lint / format config",
"detail": null,
"points": 11,
"status": "met",
"details": [],
"max_points": 11
},
{
"key": "static_type_checking",
"name": "Static type checking",
"detail": "C++ (statically typed)",
"points": 11,
"status": "met",
"details": [
{
"code": "statically_typed_language",
"params": {
"language": "C++"
}
}
],
"max_points": 11
},
{
"key": "reproducible_environment",
"name": "Reproducible environment",
"detail": "devcontainer, Dockerfile",
"points": 10,
"status": "met",
"details": [
{
"code": "file_list",
"params": {
"files": "devcontainer, Dockerfile"
}
}
],
"max_points": 10
},
{
"key": "demonstrated_agent_practice",
"name": "Demonstrated agent practice",
"detail": "no agent-authored commits among the last 100",
"points": 0,
"status": "missed",
"details": [
{
"code": "no_agent_authored_commits",
"params": {
"sampled": 100
}
}
],
"max_points": 10
},
{
"key": "automated_maintenance",
"name": "Automated maintenance",
"detail": "dependency automation configured, none observed in the sampled commits",
"points": 5,
"status": "partial",
"details": [
{
"code": "dependency_bot_config_only",
"params": {}
}
],
"max_points": 8
},
{
"key": "openssf_scorecard_pinned_dependencies",
"name": "OpenSSF Scorecard: Pinned-Dependencies",
"detail": "dependency not pinned by hash detected -- score normalized to 0",
"points": 0,
"status": "missed",
"details": [],
"max_points": 10
}
]
},
{
"key": "ai_code_legibility",
"band": "excellent",
"name": "Code legibility for models",
"note": null,
"notes": [],
"value": 100,
"inputs": {
"primary_language": "C++",
"largest_source_bytes": 2185065,
"source_files_sampled": 2072,
"oversized_source_files": 15
},
"components": [
{
"key": "type_checkable_code",
"name": "Type-checkable code",
"detail": "C++ (statically typed)",
"points": 45,
"status": "met",
"details": [
{
"code": "statically_typed_language",
"params": {
"language": "C++"
}
}
],
"max_points": 45
},
{
"key": "manageable_file_sizes",
"name": "Manageable file sizes",
"detail": "15/2072 source files over 60KB",
"points": 54.6,
"status": "partial",
"details": [
{
"code": "oversized_source_files",
"params": {
"kb": 60,
"sampled": 2072,
"oversized": 15
}
}
],
"max_points": 55
}
]
},
{
"key": "ai_interfaces",
"band": "at_risk",
"name": "Machine-readable interfaces",
"note": null,
"notes": [],
"value": 40,
"inputs": {
"example_dirs": [
"examples"
],
"has_mcp_signal": false,
"api_schema_files": []
},
"components": [
{
"key": "api_schema_openapi_graphql_proto",
"name": "API schema (OpenAPI/GraphQL/proto)",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 40
},
{
"key": "mcp_server",
"name": "MCP server",
"detail": null,
"points": 0,
"status": "missed",
"details": [],
"max_points": 20
},
{
"key": "runnable_examples",
"name": "Runnable examples",
"detail": "examples",
"points": 40,
"status": "met",
"details": [
{
"code": "file_list",
"params": {
"files": "examples"
}
}
],
"max_points": 40
}
]
}
],
"description": "How well is the repo equipped to be developed and maintained with AI coding agents? An independent, experimental badge — weight 0.0, so it is surfaced on its own and does not affect the overall health score."
}
],
"metrics_version": "1.13.0"
},
"warnings": [
"Could not fetch pypi package 'abacus_plot' from its registry",
"pypi package 'pyabacus' points at a different repository (https://github.com/Tausand-dev/PyAbacus); excluded from ecosystem scoring"
],
"report_type": "repository",
"generated_at": "2026-07-21T23:18:12.275993Z",
"schema_version": "0.26.0",
"badge_url": "https://raw.githubusercontent.com/inspect-software/badges/main/v1/a/abacusmodeling/abacus-develop.svg",
"full_name": "abacusmodeling/abacus-develop",
"license_state": "standard",
"license_spdx": "LGPL-3.0"
}