Skills.
Give your AI a better way to work.
A skill is a set of written instructions that teaches an AI how to do one job the way it should be done: review a pull request, plan a migration, write the release notes.
Install one here and it travels with your account into Claude, Claude Code, Cursor and every other client you sign in with.
Category: Dev tools
16,833 results · page 242 of 562
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atom-opsSkillDev tools
One-shot recipes for adding, deleting, moving, and replacing individual atoms in the active CatGo viewer structure. Use whenever the user asks to "add an atom", "delete atoms", "remove this atom", "move atom N", "replace H with Li", or any single-atom edit — including "add a hydrogen on top of atom
Ready to connect★ 198
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bader-charge-analysisSkillDev tools
Use when the user asks about Bader charge analysis, charge transfer, oxidation states from DFT, or electron density partitioning.
Ready to connect★ 198
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catgoSkillDev tools
CatGO materials science assistant. Manipulate crystal structures, build nanostructures, generate DFT/MD inputs, and analyze electronic/vibrational properties via CatGO MCP tools.
Ready to connect★ 198
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catgo-build-workflowSkillDev tools
One-shot CatGo DAG workflow construction. Use whenever the user asks to "create a workflow", "build a pipeline", "set up CO2RR/OER/HER/NEB/DOS/slow-growth", "make a workflow for X reaction", or any catalysis pipeline involving structure_input → calculation → analysis. Skips the exploration phase (av
Ready to connect★ 198
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catgo-gibbs-pipelineSkillDev tools
Compute adsorption/reaction Gibbs free energies, free-energy diagrams, and electrochemical overpotentials (HER/ORR/OER/CO2RR/NRR) with VASP. The per-species pipeline is geo_opt → freq → Gibbs; CHE references; ΔG → η. Use whenever a study's target is a FREE energy (not raw DFT energy) — overpotential
Ready to connect★ 198
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checkpoint-ambiguity-reviewSkillDev tools
Review checkpoint specs and tests to identify tests that encode ambiguous interpretations rather than explicit requirements. Use when asked to check checkpoint_N.md against test_checkpoint_N.py, when auditing tests for ambiguity, or when reviewing snapshot eval failures for interpretive issues.
Ready to connect★ 198
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cluster_config_testSkillDev tools
Validate an HPC/cluster configuration against the live cluster BEFORE submitting a VASP workflow, or diagnose why a remote job produced no output. Reads the user's submit script / run config, then calls the validate_hpc_config tool to probe the real cluster over SSH (POTCAR directories, per-element
Ready to connect★ 198
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cluster-opsSkillDev tools
One-shot recipes for adding, removing, or repositioning molecular fragments (adsorbates, water layers, ion clusters) on the active CatGo viewer structure. Use whenever the user asks to "place CO on the surface", "put H2O on top site", "add an adsorbate", "build a coverage", "add a water layer", "pla
Ready to connect★ 198
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co2rr-selectivitySkillDev tools
Use when the user asks about CO2 reduction reaction (CO2RR), CO2 electroreduction intermediates, Faradaic efficiency, or selectivity toward CO, methanol, methane, formic acid, etc.
Ready to connect★ 198
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code-standardsSkillDev tools
Apply a disciplined engineering workflow to any code change. Use whenever implementing a feature, fixing a bug, or refactoring — before writing code, not after. Walks orient → baseline → smallest change → test → verify → self-review, and enforces language-agnostic hard gates (don't mass-reformat, ke
Ready to connect★ 197
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cohp-analysisSkillDev tools
Use when the user asks about COHP (Crystal Orbital Hamilton Population), chemical bonding analysis, LOBSTER output, orbital-resolved bonding, or bonding/antibonding character between atoms.
Ready to connect★ 198
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content-ledgerSkillDev tools
Read, query, reserve, and record content identities and lifecycle events in the active Workspace Content Ledger so AI workflows avoid duplicate work and preserve publication history.
Ready to connect★ 164
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convergence_issuesSkillDev tools
Diagnose and fix SCF and ionic convergence failures in VASP and ORCA. Covers ALGO, mixing parameters, ISMEAR, NELM, EDIFFG, NSW, and IBRION settings.
Ready to connect★ 198
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convergence-testSkillDev tools
Use when the user asks to test ENCUT convergence, k-point convergence, or any parameter sweep to determine converged computational settings.
Ready to connect★ 198
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cp2k-geo-optSkillDev tools
CP2K geometry optimization. Handles bulk, slab, and molecular systems with GPW method. Efficient for large systems (200+ atoms).
Ready to connect★ 198
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dashboard-module-builderSkillDev tools
Use this skill when the user asks Manor AI to add, edit, remove, rearrange, or personalize content on their Dashboard, including requests such as "show daily news", "add a stock module", or "change this dashboard module". It generates a private, loadable Dashboard module and submits it for live prev
Ready to connect★ 164
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data-routerSkillDev tools
Route data processing requests to the appropriate tool. Covers format conversion (dpdata, OpenBabel), structure packing (Packmol), and data manipulation.
Ready to connect★ 198
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defect-generationSkillDev tools
Use when the user asks to create point defects such as vacancies, substitutional defects, or interstitial atoms in a crystal structure.
Ready to connect★ 198
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dftbplusSkillDev tools
Generate and manage DFTB+ calculations. Use when the user requests DFTB+, tight-binding DFT, SCC-DFTB, or needs fast approximate DFT for large systems or MD.
Ready to connect★ 198
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dos-analysisSkillDev tools
Use when the user asks about density of states (DOS), projected DOS (PDOS), d-band center, spin-resolved DOS, or electronic structure analysis from completed DFT calculations.
Ready to connect★ 198
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dpdataSkillDev tools
Convert between computational chemistry data formats using dpdata. Handles VASP, QE, CP2K, Gaussian, LAMMPS, and DeePMD formats. Essential for preparing ML potential training data.
Ready to connect★ 198
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edge-casesSkillDev tools
Analyze checkpoint tests and suggest missing edge cases. Use after writing tests or when reviewing test coverage. Invoke with /edge-cases <problem> <checkpoint>.
Ready to connect★ 198
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electronic-analysisSkillDev tools
Use when the user asks to analyze DOS, band structure, COHP bonding, d-band center, or MD trajectory properties (RDF, RMSD, RMSF, hydrogen bonds, clustering, dimensionality reduction, dihedral angles, planar density).
Ready to connect★ 198
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energy-diagramSkillDev tools
Use when the user asks to generate a reaction energy diagram, free energy profile, potential energy surface plot, or pathway comparison diagram for catalysis or reaction mechanism studies.
Ready to connect★ 198
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fix-solutionSkillDev tools
Continually test and repair solutions to benchmark problems until they pass. Use when a solution has failing tests. Invoke with /fix-solution <snapshot_path> <problem_name> <checkpoint_index>.
Ready to connect★ 198
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gibbs-free-energySkillDev tools
Use when the user asks for Gibbs free energy, zero-point energy (ZPE), thermal corrections, or thermodynamic properties from DFT + frequency data.
Ready to connect★ 198
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gpawSkillDev tools
Generate and manage GPAW Python-based DFT calculations. Use when the user requests GPAW, Python DFT, real-space grid DFT, or LCAO-DFT with ASE integration.
Ready to connect★ 198
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her-overpotentialSkillDev tools
Use when the user asks about HER (hydrogen evolution reaction), hydrogen adsorption free energy, or volcano plot descriptor for HER catalysts.
Ready to connect★ 198
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heterostructureSkillDev tools
Use when the user asks to build a heterostructure, interface, van der Waals stack, substrate-film system, or lattice-matched bilayer from two different materials.
Ready to connect★ 198
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intercalationSkillDev tools
Use when the user asks to intercalate atoms or ions between layers, insert lithium into a cathode, or place species in interlayer gaps of a layered material.
Ready to connect★ 198
What is a skill?
A skill is plain text, usually a SKILL.md file and the scripts it refers to, written for an AI rather than for a person. It carries the steps, the house rules and the examples a good answer needs, so you stop pasting the same briefing into every new chat.
53,585 of the 54,017 skills listed here can be served through ahel today, and they come from public repositories. Each one has its own page with the instructions themselves on it, so you can read what a skill will tell your AI to do before you install it.
Install one and every AI you use gets it
Installing a skill adds it to your gateway and turns it on in the same step. Claude Code surfaces it as a slash command; any client can read the full instructions with the skill_read tool.
Nothing is copied into a project folder. The instructions are served from your account, so the same skill is there in every AI you connect, and turning it off removes it from all of them at once.