Public recordCritical
Software health reportschema 0.16.0 · metrics 1.13.0 · 2026-07-20 17:51 UTC
tilde-lab / aiida-crystal-dft
AiiDA plugin for the ab initio modeling suite CRYSTAL, developed in Turin University
tilde-lab/aiida-crystal-dft holds a health index of 27 out of 100, placing it in the Critical band. It scores highest on Vitality (67/100) and lowest on AI Readiness (25/100). It was last updated 5 days ago. A single contributor accounts for most of its recent work.
27
overall / 100Software health index
Metrics are grouped into weighted categories on one standardized 1–100 scale. Overall starts as their weighted mean; when public evidence triggers the High-Risk Jurisdiction Policy, the rating is adjusted and receives an At risk ceiling of 49. AI Readiness sits outside the overall score.
27
Excellent85-100Exemplary; meets essentially all checked criteria
Good70-84Healthy; minor gaps
Moderate50-69Acceptable with notable gaps; review recommended
At risk30-49Significant weaknesses; adoption warrants caution
Critical1-29Severe problems (abandoned, single-maintainer, no hygiene)
Score profile
Each axis is a category. The shape matters more than the average — a healthy subject fills the whole shape, while a spike-and-crater profile means strength in one dimension is masking risk in another.
High-Risk Jurisdiction Policy applies a 50% multiplier to weighted overall health and gives it an At risk ceiling of 49.
Ownership
TildeOrganization
60 followers32 public repossince Mar 2015
This repository is backed by an organization — shared, accountable stewardship that can outlive any single maintainer.
Package ecosystems
| Registry | Package | Version | Downloads / mo | Versions | Last publish | Tags |
|---|---|---|---|---|---|---|
| PyPI | aiida-crystal-dft | 0.9.4 | 314 | 2 | 117 days ago | aiidaplugin |
Metrics by category
Vitality
Is the project alive — is code being written and are releases shipping?
67
Development activity
67Moderate
How it's scored
| 36/36 | Push recency — last push 5 days ago |
| 6.2/36 | Commit cadence — 9/52 weeks with commits |
| 14.6/18 | Commit volume — 41 commits in the last year |
| 10/10 | OpenSSF Scorecard: Maintained — 25 commit(s) and 2 issue activity found in the last 90 days -- score normalized to 10 |
Inputs used
| commits_last_year | 41 |
| human_commit_share | — |
| days_since_last_push | 5 |
| active_weeks_last_year | 9 |
Release discipline
66Moderate
How it's scored
| 27/27 | Ships releases — 6 releases published |
| 27/36 | Release recency — latest release 117 days ago |
| 5.4/27 | Release cadence — a release every ~513.4 days |
| 0/10 | OpenSSF Scorecard: Signed-Releases — no data |
Inputs used
| releases_count | 6 |
| latest_release_tag | v0.9.4 |
| releases_from_tags | no |
| days_since_latest_release | 117 |
| mean_days_between_releases | 513.4 |
Excluded from scoring (no data or not applicable): OpenSSF Scorecard: Signed-Releases. Remaining weights renormalized.
Community & Adoption
Does the project have users, downloads, attention, and a welcoming setup for contributors?
33
Popularity & adoption
12Critical
How it's scored
| 4.9/60 | Stars — 3 stars |
| 5/25 | Forks — 5 forks |
| 1.7/15 | Watchers — 3 watchers |
Inputs used
| forks | 5 |
| stars | 3 |
| watchers | 3 |
| growth_state | unverified |
| growth_factor_pct | 100 |
| growth_unverified_reason | no_history |
Community health
50Moderate
How it's scored
| 22.5/22.5 | README |
| 22.5/22.5 | License — recognized license (MIT) |
| 0/18 | CONTRIBUTING guide |
| 0/13.5 | Code of conduct |
| 0/7.2 | Issue template |
| 0/6.3 | PR template |
Inputs used
| has_readme | yes |
| has_license | yes |
| has_contributing | no |
| has_issue_template | no |
| has_code_of_conduct | no |
| has_pull_request_template | no |
Ecosystem adoption (downloads)
42At risk
How it's scored
| 33.3/80 | Monthly downloads — 314 downloads/month across pypi |
| 0/20 | Registry dependents — not reported by this ecosystem |
Inputs used
| packages | aiida-crystal-dft |
| dependents | — |
| ecosystems | pypi |
| total_downloads | — |
| monthly_downloads | 314 |
Excluded from scoring (no data or not applicable): Registry dependents. Remaining weights renormalized.
Sustainability & Governance
Will the project survive its people — bus factor, responsiveness, who backs it, and package upkeep?
65
Maintainer resilience (bus factor)
34At risk
How it's scored
| 9/54 | Bus factor — 1 contributor(s) cover half of all commits |
| 7.1/22.5 | Commit distribution — top contributor authored 68% of commits |
| 8.1/13.5 | Contributor breadth — 6 contributors |
| 10/10 | OpenSSF Scorecard: Contributors — project has 13 contributing companies or organizations |
Inputs used
| bus_factor | 1 |
| contributors_sampled | 6 |
| top_contributor_share | 0.683 |
How it's scored
| 33.6/46.8 | Issue resolution — 72% of issues closed |
| 38.2/38.3 | PR acceptance — 23/23 decided PRs merged |
| 9/15 | OpenSSF Scorecard: Code-Review — Found 6/9 approved changesets -- score normalized to 6 |
Inputs used
| merged_prs | 23 |
| open_issues | 18 |
| closed_issues | 46 |
| issue_closed_ratio | 0.719 |
| closed_unmerged_prs | 0 |
Ownership & stewardship
66Moderate
How it's scored
| 30/30 | Ownership backing — organization-owned |
| 0/20 | Verified domain |
| 12.8/25 | Owner reach — 60 followers of tilde-lab |
| 23.1/25 | Track record — 32 public repos, account ~11 yr old |
Inputs used
| followers | 60 |
| owner_type | Organization |
| is_verified | — |
| owner_login | tilde-lab |
| public_repos | 32 |
| account_age_days | 4,147 |
Package maintenance
92Excellent
How it's scored
| 25/25 | Published & resolvable — 1 package(s) on pypi |
| 35/35 | Publish recency — latest publish 117 days ago |
| 12/20 | Version history — 2 published versions |
| 20/20 | Not deprecated — active, not deprecated or yanked |
Inputs used
| packages | aiida-crystal-dft |
| ecosystems | pypi |
| any_deprecated | no |
| min_days_since_publish | 117 |
Engineering Quality
Are baseline engineering and documentation practices in place?
61
Engineering practices
68Moderate
How it's scored
| 24/24 | CI workflows — 2 workflow(s) |
| 24/24 | Tests present |
| 0/16 | Linter config |
| 0/9.6 | Pre-commit hooks |
| 0/6.4 | .editorconfig |
| 20/20 | OpenSSF Scorecard: CI-Tests — 6 out of 6 merged PRs checked by a CI test -- score normalized to 10 |
Inputs used
| has_ci | yes |
| has_tests | yes |
| has_editorconfig | no |
| has_linter_config | no |
| has_precommit_config | no |
Documentation
50Moderate
How it's scored
| 30/30 | README |
| 0/25 | Documentation directory |
| 0/15 | Documentation / homepage site |
| 10/10 | Repository description |
| 10/10 | Topics — 4 topics |
| 0/10 | Wiki |
Inputs used
| topics | atomistic-simulations, aiida, quantum-chemistry, aiida-plugin |
| has_wiki | no |
| homepage | — |
| has_readme | yes |
| has_docs_dir | no |
| has_description | yes |
Security
Are visible security and supply-chain practices strong, without unresolved high-risk jurisdiction exposure?
34
Security posture
27Critical
Jurisdiction risk alert
High-risk jurisdiction exposure detected
1 contributor organization profilesRussia1 top contributor profilesRussiaSecurity and overall rating: At risk ceiling
Based on self-published public profile locations. This governance signal does not determine nationality, citizenship, intent, sanctions status, or individual trustworthiness.
How jurisdiction exposure is assessedHow it's scored
| 7.5/7.5 | Binary-Artifacts — no binaries found in the repo |
| 0/7.5 | Branch-Protection — branch protection not enabled on development/release branches |
| 2.5/2.5 | CI-Tests — 6 out of 6 merged PRs checked by a CI test -- score normalized to 10 |
| 0/2.5 | CII-Best-Practices — no effort to earn an OpenSSF best practices badge detected |
| 4.5/7.5 | Code-Review — Found 6/9 approved changesets -- score normalized to 6 |
| 2.5/2.5 | Contributors — project has 13 contributing companies or organizations |
| 10/10 | Dangerous-Workflow — no dangerous workflow patterns detected |
| 0/7.5 | Dependency-Update-Tool — no update tool detected |
| 0/5 | Fuzzing — project is not fuzzed |
| 2.5/2.5 | License — license file detected |
| 7.5/7.5 | Maintained — 25 commit(s) and 2 issue activity found in the last 90 days -- score normalized to 10 |
| 0/5 | Packaging — no data |
| 0/5 | Pinned-Dependencies — dependency not pinned by hash detected -- score normalized to 0 |
| 5/5 | SAST — SAST tool is run on all commits |
| 0/5 | Security-Policy — security policy file not detected |
| 0/7.5 | Signed-Releases — no data |
| 0/7.5 | Token-Permissions — detected GitHub workflow tokens with excessive permissions |
| 7.5/7.5 | Vulnerabilities — 0 existing vulnerabilities detected |
Inputs used
| source | openssf_scorecard |
| checks_evaluated | 16 |
| scorecard_version | v5.5.0 |
| checks_inconclusive | 2 |
| scorecard_aggregate | 5.4 |
| high_risk_jurisdiction_cap | 49 |
| high_risk_jurisdiction_multiplier | 50 |
| security_posture_after_multiplier | 27 |
| security_posture_before_jurisdiction | 54 |
Excluded from scoring (no data or not applicable): packaging, signed_releases. Remaining weights renormalized. High-Risk Jurisdiction Policy applies a 50% multiplier and gives Security posture an At risk ceiling of 49.
Dependency advisories
63Moderate
How it's scored
| 14.8/35 | Direct dependencies free of known advisories — 1 affected: click 8.1.8 (high 7.2) |
| 13.2/25 | Indirect dependencies free of known advisories — 1 affected: paramiko 2.12.0 (moderate 5.9) |
| 34.9/40 | No advisories left outstanding — 1 advisory-carrying package(s) unaddressed past 90 days; oldest published 944 days ago |
Inputs used
| source | osv |
| advisories | 5 |
| affected_packages | 2 |
| assessed_packages | 93 |
| unassessed_packages | 0 |
| affected_by_severity | high 1, moderate 1 |
| direct_affected_packages | 1 |
Matched the pypi:aiida-crystal-dft@0.9.4 runtime dependency closure — what installing the published package pulls in — 93 packages. Reachability is not analyzed.
AI Readiness
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.
25
Agent context & guidance
1Critical
How it's scored
| 0/45 | Agent instructions — no CLAUDE.md / AGENTS.md / editor rules |
| 0/15 | Machine-readable docs (llms.txt) |
| 0/40 | Legible commit history — no data |
Inputs used
| has_llms_txt | no |
| legible_history_share | — |
| agent_instruction_files | — |
| agent_instruction_max_bytes | — |
Excluded from scoring (no data or not applicable): Legible commit history. Remaining weights renormalized.
Verify loop (build / test / typecheck)
27Critical
How it's scored
| 0/18 | One-command bootstrap |
| 22/22 | Automated tests |
| 0/11 | Lint / format config |
| 0/11 | Static type checking |
| 0/10 | Reproducible environment |
| 0/10 | Demonstrated agent practice — no data |
| 0/8 | Automated maintenance — no data |
| 0/10 | OpenSSF Scorecard: Pinned-Dependencies — dependency not pinned by hash detected -- score normalized to 0 |
Inputs used
| has_nix | no |
| has_tests | yes |
| lockfiles | — |
| has_dockerfile | no |
| typed_language | no |
| bootstrap_files | — |
| has_devcontainer | no |
| has_linter_config | no |
| typecheck_configs | — |
| agent_commit_share | — |
| toolchain_manifests | — |
| dependency_bot_commit_share | — |
Excluded from scoring (no data or not applicable): Demonstrated agent practice, Automated maintenance. Remaining weights renormalized.
Code legibility for models
55Moderate
How it's scored
| 0/45 | Type-checkable code — Python without a type-check config |
| 55/55 | Manageable file sizes — 0/79 source files over 60KB |
Inputs used
| primary_language | Python |
| largest_source_bytes | 14,373 |
| source_files_sampled | 79 |
| oversized_source_files | 0 |
Machine-readable interfaces
40At risk
How it's scored
| 0/40 | API schema (OpenAPI/GraphQL/proto) |
| 0/20 | MCP server |
| 40/40 | Runnable examples — examples |
Inputs used
| example_dirs | examples |
| has_mcp_signal | no |
| api_schema_files | — |
Key facts
3GitHub stars
6contributors
41commits, last 12 months
5days since last push
6releases
1bus factor
18open issues
PyPIpackage ecosystems
More detail
OpenSSF Scorecard 5.4 / 10
5.4aggregate
Independent, tool-agnostic security assessment from the open-source OpenSSF Scorecard. Each check rewards a security practice, not a specific vendor's tool. Checks Scorecard could not determine are marked n/a and excluded from the security score (never counted as zero).
| 10 | Binary-Artifacts | no binaries found in the repo |
| 0 | Branch-Protection | branch protection not enabled on development/release branches |
| 10 | CI-Tests | 6 out of 6 merged PRs checked by a CI test -- score normalized to 10 |
| 0 | CII-Best-Practices | no effort to earn an OpenSSF best practices badge detected |
| 6 | Code-Review | Found 6/9 approved changesets -- score normalized to 6 |
| 10 | Contributors | project has 13 contributing companies or organizations |
| 10 | Dangerous-Workflow | no dangerous workflow patterns detected |
| 0 | Dependency-Update-Tool | no update tool detected |
| 0 | Fuzzing | project is not fuzzed |
| 10 | License | license file detected |
| 10 | Maintained | 25 commit(s) and 2 issue activity found in the last 90 days -- score normalized to 10 |
| n/a | Packaging | packaging workflow not detected |
| 0 | Pinned-Dependencies | dependency not pinned by hash detected -- score normalized to 0 |
| 10 | SAST | SAST tool is run on all commits |
| 0 | Security-Policy | security policy file not detected |
| n/a | Signed-Releases | no releases found |
| 0 | Token-Permissions | detected GitHub workflow tokens with excessive permissions |
| 10 | Vulnerabilities | 0 existing vulnerabilities detected |
Direct dependencies 12
| Registry | Package | Version constraint | Manifest |
|---|---|---|---|
| PyPI | numpy | >= 1.17.5 | pyproject.toml |
| PyPI | scipy | >= 1.2.1 | pyproject.toml |
| PyPI | aiida-core | < 2.9.0 | pyproject.toml |
| PyPI | pycrystal | >= 1.1.0 | pyproject.toml |
| PyPI | mpds_client | >= 0.24 | pyproject.toml |
| PyPI | pyparsing | > 2.3.1 | pyproject.toml |
| PyPI | ase | >= 3.19 | pyproject.toml |
| PyPI | spglib | — | pyproject.toml |
| PyPI | jinja2 | >= 2.10 | pyproject.toml |
| PyPI | jsonschema | >= 3.0.1 | pyproject.toml |
| PyPI | click | >= 7.1.1 | pyproject.toml |
| PyPI | packaging | — | pyproject.toml |
All dependencies 20
Full resolved dependency set from the GitHub dependency graph: 10 direct and 10 indirect (transitive) packages. The transitive closure is complete when the repository commits a lockfile.
| Registry | Package | Version | Relation |
|---|---|---|---|
| PyPI | aiida-core | — | direct |
| PyPI | ase | — | direct |
| PyPI | click | — | direct |
| PyPI | jinja2 | — | direct |
| PyPI | jsonschema | — | direct |
| PyPI | mpds-client | — | direct |
| PyPI | numpy | — | direct |
| PyPI | pycrystal | — | direct |
| PyPI | pyparsing | — | direct |
| PyPI | scipy | — | direct |
| PyPI | flit-core | — | indirect |
| PyPI | mock | 2.0.0 | indirect |
| PyPI | pgtest | — | indirect |
| PyPI | pre-commit | 1.10.5 | indirect |
| PyPI | prospector | 1.1.2 | indirect |
| PyPI | pylint | 1.8.4 | indirect |
| PyPI | pytest | — | indirect |
| PyPI | sqlalchemy-diff | 0.1.3 | indirect |
| PyPI | wheel | — | indirect |
| PyPI | yapf | 0.22.0 | indirect |
Dependency advisories 2
Installing pypi:aiida-crystal-dft@0.9.4 pulls in 93 packages, direct and transitive: 2 carry known advisories, of which 1 are direct dependencies.
| Package | Version | Relation | Severity | Advisories | Fixed in |
|---|---|---|---|---|---|
| click | 8.1.8 | direct | high | 1 | 8.3.3 |
| paramiko | 2.12.0 | indirect | moderate | 4 | 3.4.0 |
An advisory means the version recorded in the dependency graph falls inside an advisory’s affected range. Reachability is not analysed, and the graph includes development and test pins — a finding may concern tooling rather than shipped software.
Raw JSON report machine-readable
{
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"Programming Language :: Python",
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"Programming Language :: Python :: 3.11",
"Programming Language :: Python :: 3.12",
"Programming Language :: Python :: 3.8",
"Programming Language :: Python :: 3.9",
"Topic :: Scientific/Engineering",
"Topic :: Scientific/Engineering :: Chemistry",
"Topic :: Scientific/Engineering :: Information Analysis",
"Topic :: Scientific/Engineering :: Physics"
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"ai_readiness": {
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"has_llms_txt": false,
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},
"dependencies": {
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],
"advisories": {
"error": null,
"scope": "published_package",
"source": "osv",
"findings": [
{
"name": "click",
"direct": true,
"version": "8.1.8",
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"ecosystem": "pypi",
"cvss_score": 7.2,
"advisory_ids": [
"PYSEC-2026-2132"
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{
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"advisory_ids": [
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"GHSA-r374-rxx8-8654",
"PYSEC-2026-1758",
"PYSEC-2026-2858"
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"collected": true,
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"affected_count": 2,
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"ecosystem": "pypi",
"version_constraint": "< 2.9.0"
},
{
"name": "pycrystal",
"manifest": "pyproject.toml",
"ecosystem": "pypi",
"version_constraint": ">= 1.1.0"
},
{
"name": "mpds_client",
"manifest": "pyproject.toml",
"ecosystem": "pypi",
"version_constraint": ">= 0.24"
},
{
"name": "pyparsing",
"manifest": "pyproject.toml",
"ecosystem": "pypi",
"version_constraint": "> 2.3.1"
},
{
"name": "ase",
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"ecosystem": "pypi",
"version_constraint": ">= 3.19"
},
{
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"ecosystem": "pypi",
"version_constraint": null
},
{
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"version_constraint": ">= 2.10"
},
{
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"ecosystem": "pypi",
"version_constraint": ">= 3.0.1"
},
{
"name": "click",
"manifest": "pyproject.toml",
"ecosystem": "pypi",
"version_constraint": ">= 7.1.1"
},
{
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"manifest": "pyproject.toml",
"ecosystem": "pypi",
"version_constraint": null
}
],
"all_dependencies": {
"error": null,
"source": "github-sbom",
"packages": [
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"direct": true,
"version": null,
"ecosystem": "pypi"
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{
"name": "ase",
"direct": true,
"version": null,
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},
{
"name": "click",
"direct": true,
"version": null,
"ecosystem": "pypi"
},
{
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"direct": true,
"version": null,
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},
{
"name": "jsonschema",
"direct": true,
"version": null,
"ecosystem": "pypi"
},
{
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"direct": true,
"version": null,
"ecosystem": "pypi"
},
{
"name": "numpy",
"direct": true,
"version": null,
"ecosystem": "pypi"
},
{
"name": "pycrystal",
"direct": true,
"version": null,
"ecosystem": "pypi"
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}
],
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},
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"generated_at": "2026-07-20T17:51:05.280332Z",
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"badge_url": "https://raw.githubusercontent.com/inspect-software/badges/main/v1/t/tilde-lab/aiida-crystal-dft.svg",
"full_name": "tilde-lab/aiida-crystal-dft",
"license_state": "standard",
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}Scores are signals, not warranties. They reflect publicly visible practices on GitHub — not a code audit, and not a security guarantee.
Missing data is excluded and weights renormalized, never scored as zero. Methodology is versioned and open: metrics v1.13.0, schema v0.16.0 — full methodology · metrics wiki.
How one result sits in the wider record: aggregate statistics — PyPI.