| Skill | Added | Review |
|---|---|---|
achemso-latex-manuscript writing_skills/achemso-latex-manuscript/SKILL.md Write ACS-style manuscript sections against the local achemso LaTeX template, using deterministic template edits and preserving BibTeX structure. | 59 59 Impact — No eval scenarios have been run Securityby  Passed No findings from the security scan Version: c87fc76 | |
adsorbate-and-intermediate-generation skills/adsorbate-and-intermediate-generation/SKILL.md Use this skill for generating adsorbates and reaction intermediates, standardizing molecular inputs, and preparing structures for adsorption placement. | 64 64 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
adsorption-site-screening skills/adsorption-site-screening/SKILL.md Use this skill for adsorption-site enumeration and adsorbate placement workflows, including candidate screening setup and batch structure generation. | 63 63 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
catalysis-prior-art-and-benchmarking skills/catalysis-prior-art-and-benchmarking/SKILL.md Use this skill when a catalysis workflow needs literature-grounded benchmark papers, prior-art mapping, representative method conventions, or evidence-backed comparisons. | 64 64 Impact — No eval scenarios have been run Securityby Low Low-risk findings worth noting Version: c87fc76 | |
citation-management writing_skills/citation-management/SKILL.md Comprehensive citation management for academic research. Search Google Scholar and PubMed for papers, extract accurate metadata, validate citations, and generate properly formatted BibTeX entries. This skill should be used when you need to find papers, verify citation information, convert DOIs to BibTeX, or ensure reference accuracy in scientific writing. | 76 76 1.84x Agent success vs baseline Impact 81% 1.84xAverage score across 3 eval scenarios Securityby Low Low-risk findings worth noting Reviewed: Version: c87fc76 | |
computational-heterogeneous-catalysis skills/computational-heterogeneous-catalysis/SKILL.md Use this skill for end-to-end heterogeneous catalysis workflows, including proposal framing, slab and adsorbate strategy, reaction/energy evaluation, and evidence standards for comparing catalyst candidates. | 56 56 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
figure-design-and-captioning writing_skills/figure-design-and-captioning/SKILL.md Design evidence-carrying figures and captions from research outputs, with reproducible script and data references. | 52 52 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
literature-grounding skills/literature-grounding/SKILL.md Use this skill when the user asks for papers, prior work, literature support, benchmark conventions, or other explicit evidence grounding from published work. | 54 54 Impact — No eval scenarios have been run Securityby Low Low-risk findings worth noting Version: c87fc76 | |
mace-screening-and-relaxation skills/mace-screening-and-relaxation/SKILL.md Use this skill for MACE-based rapid screening and relaxation loops before DFT, including candidate pruning and handoff criteria. | 61 61 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
materials-discovery-and-bulk-selection skills/materials-discovery-and-bulk-selection/SKILL.md Use this skill for materials discovery and bulk structure selection before slab construction, including database query strategy, candidate filtering, and export readiness. | 61 61 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
results-and-discussion-writing writing_skills/results-and-discussion-writing/SKILL.md Write Results and Discussion sections that separate observations from interpretation and preserve uncertainty. | 60 60 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
scientific-visualization writing_skills/scientific-visualization/SKILL.md Meta-skill for publication-ready figures. Use when creating journal submission figures requiring multi-panel layouts, significance annotations, error bars, colorblind-safe palettes, and specific journal formatting (Nature, Science, Cell). Orchestrates matplotlib/seaborn/plotly with publication styles. For quick exploration use seaborn or plotly directly. | 56 56 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
scientific-writing writing_skills/scientific-writing/SKILL.md Core skill for the deep research and writing tool. Write scientific manuscripts in full paragraphs (never bullet points). Use two-stage process with (1) section outlines with key points using research-lookup then (2) convert to flowing prose. IMRAD structure, citations (APA/AMA/Vancouver), figures/tables, reporting guidelines (CONSORT/STROBE/PRISMA), for research papers and journal submissions. | 53 53 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
slab-construction-and-surface-modeling skills/slab-construction-and-surface-modeling/SKILL.md Use this skill for slab construction, vacuum and layer choices, surface supercell setup, and atom-fixing strategy in heterogeneous catalysis workflows. | 66 66 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
structure-visual-inspection skills/structure-visual-inspection/SKILL.md Use this skill when a task needs visual inspection of atomic structures, adsorption geometries, slab-site context, or image-based sanity checks before or alongside numerical analysis. | 61 61 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
thermo-free-energy-and-reporting skills/thermo-free-energy-and-reporting/SKILL.md Use this skill for thermodynamic and free-energy post-processing, result normalization, and concise reporting standards for catalyst comparison. | 48 48 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
transition-state-neb skills/transition-state-neb/SKILL.md Use this skill for transition-state and NEB workflows, including image generation, INCAR setup, and execution/evidence checks for pathway calculations. | 61 61 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
vasp-batch-execution skills/vasp-batch-execution/SKILL.md Use this skill for dispatching prepared VASP jobs with vasp_execute_batch, choosing valid input/output layouts, avoiding nested or overlapping calc trees, and collecting clean failure evidence. | 69 69 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
vasp-input-preparation skills/vasp-input-preparation/SKILL.md Use this skill for preparing VASP relaxation and single-point input sets, choosing calc_type and key defaults correctly, handling INCAR override edge cases, and producing execution-ready folder layouts before dispatch. | 64 64 Impact — No eval scenarios have been run Securityby Passed No findings from the security scan Version: c87fc76 | |
venue-templates writing_skills/venue-templates/SKILL.md Access comprehensive LaTeX templates, formatting requirements, and submission guidelines for major scientific publication venues (Nature, Science, PLOS, IEEE, ACM), academic conferences (NeurIPS, ICML, CVPR, CHI), research posters, and grant proposals (NSF, NIH, DOE, DARPA). This skill should be used when preparing manuscripts for journal submission, conference papers, research posters, or grant proposals and need venue-specific formatting requirements and templates. | 86 86 1.52x Agent success vs baseline Impact 96% 1.52xAverage score across 6 eval scenarios Securityby Passed No findings from the security scan Reviewed: Version: c87fc76 |