Use OVITO or the OVITO Python module for atomistic visualization and analysis of structures and trajectories, including rendering, common-neighbor/PTM structure classification, coordination/RDF…

Custom licenceAuto-check passed

Install Ovito

skills CLI
$ npx skills add JCLiuGroup/AI-Computational-Chemist --skill ovito -a claude-code

Project install by default; add -g for ~/.claude/skills/.

GitHub CLI
$ gh skill install JCLiuGroup/AI-Computational-Chemist ovito --agent claude-code

Project scope by default; add --scope user for a personal install. Needs GitHub CLI 2.90.0 or later (public preview).

Manual copy
$ git clone --depth 1 https://github.com/JCLiuGroup/AI-Computational-Chemist.git skills-src && mkdir -p .claude/skills && cp -r skills-src/tools/ovito .claude/skills/ovito && rm -rf skills-src

Use ~/.claude/skills/ instead of .claude/skills for a personal install. The folder must contain SKILL.md.

Claude Code skills documentation · loads skills from .claude/skills/

Facts

Skill name
ovito
GitHub stars
145
Used in
1 other repo
Token cost
~702 tokens
SKILL.md length
301 words
Files
9 (incl. scripts, references)
Skills in repo
21
Repo updated
First seen
Licence
Custom licence

At a glance

Use OVITO or the OVITO Python module for atomistic visualization and analysis of structures and trajectories, including rendering, common-neighbor/PTM structure classification, coordination/RDF…

  • Works in 5 steps: Confirm the source file and units with… → Load running.md for the matching task… → For quantitative analysis, run… → …
  • SKILL.md covers Required inputs, Where to find what, Workflow and Hard guardrails
  • Runs Python scripts from its folder

What it does

Ovito is an agent skill from JCLiuGroup/AI-Computational-Chemist. Use OVITO or the OVITO Python module for atomistic visualization and analysis of structures and trajectories, including rendering, common-neighbor/PTM structure classification, coordination/RDF, surface meshes, Wigner-Seitz defects, and trajectory-derived figures.

Its SKILL.md is about 700 tokens, which your agent loads only when the skill is triggered. The skill folder holds 11 other files, including scripts and reference files (for example `examples/README.md`, `references/errors.md` and `references/resources.md`).

It works with Python.

Example prompts

  • “/ovito”

Requirements

  • Python 3

Workflow steps

5 steps, taken from the first numbered list in SKILL.md.

  1. Confirm the source file and units with the engine skill that produced it.
  2. Load running.md for the matching task family.
  3. For quantitative analysis, run ovito_analyze.py on a small frame range first; inspect counts and warnings.
  4. For figures, run ovito_render.py and visually inspect the image before using it in a report.
  5. Save the script, source file path, OVITO version, modifier parameters, frame range, and rendered/exported artifacts.

What it can do on your machine

Read from SKILL.md and the folder at commit e27b555. It shows what the files ask for, not the result of running them.

  • Tool permissions

    Pre-approves nothing: there is no allowed-tools line, so your agent's usual permission prompts apply.

    From allowed-tools in the SKILL.md frontmatter.

  • Runs code

    Ships 2 files in scripts/ (Python), which the agent can run.

    From the folder's file list and the shell code blocks in SKILL.md.

  • Network

    No URLs in SKILL.md.

    From URLs in SKILL.md, links to its own repository left out.

  • Credentials

    Names no API keys, tokens, secrets or passwords.

    From names ending in _API_KEY, _TOKEN, _SECRET, _KEY or _PASSWORD in SKILL.md.

Context cost

Ovito loads about 702 tokens when it runs, and up to ~6.4k if it reads all its reference files. Until then it costs about 68 tokens; SKILL.md has 301 words of instructions outside code blocks.

Always · name and description, kept in context so the agent knows when to use it
~68
When it runs · the whole SKILL.md, loaded when a task matches
~702
With references · SKILL.md plus every file in references/, read only if the agent opens them
~6.4k

Estimates: characters ÷ 4, the usual rule of thumb; real counts depend on the model's tokenizer. Scripts and assets cost tokens only if the agent reads them.

Safety

Auto-check passed

The automated check found no risky patterns in SKILL.md.

Automated static check — not a guarantee. Review scripts before installing. It scans the text of SKILL.md for risky patterns (piping downloads into a shell, reading credential files, hidden Unicode, destructive commands); the scripts in this folder are not scanned.

SKILL.md

Its licence (Custom licence) doesn't allow us to republish the file, so here is its outline and opening line. It has 301 words (~702 tokens).

“Use this skill when the task is visual inspection, publication-style rendering, or atomistic trajectory/structure analysis with OVITO. It pairs naturally with VASP, LAMMPS, MLP, and structure-prep outputs.”

— opening of SKILL.md by JCLiuGroup, Custom licence
name
ovito

Read the full SKILL.md on GitHub

Files

SKILL.md and 8 other files (scripts, references) in tools/ovito of JCLiuGroup/AI-Computational-Chemist.

  • SKILL.md
  • examples/README.md
  • references/errors.md
  • references/resources.md
  • references/running.md
  • references/structure-rendering.md
  • references/validation.md
  • scripts/ovito_analyze.py
  • scripts/ovito_render.py

Open the folder on GitHubat commit e27b555

Used in 1 other repository

We found 2 copies of this SKILL.md (exact, near-identical or edited) in other folders, from 1 other GitHub owner. This page covers the copy in JCLiuGroup/AI-Computational-Chemist, which our catalogue first saw on October 7, 2026.

Compare with similar skills

Ovito next to the 5 skills that share the most tags, products or categories with it. Stars are the repository's; “used in” counts other GitHub owners with a copy.

Ovito compared with similar skills
SkillStarsUsed inTokensAuto-checkLicenceRepo updated
Ovito this skillJCLiuGroup/AI-Computational-Chemist1451 repos~702Automated safety check: PassCustom licence
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PDF Processinganthropics/skills180k48 repos~2kAutomated safety check: PassProprietary
NotebookLM Research AssistantPleasePrompto/notebooklm-skill7.8k14 repos~2.4kAutomated safety check: NotesMIT
Manim Video Productionbrowser-use/video-use28k6 repos~3kAutomated safety check: PassMIT
Code Review ChecklistshareAI-lab/learn-claude-code78k5 repos~1.1kAutomated safety check: PassMIT

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Works with

Questions about Ovito

What does Ovito do?

Use OVITO or the OVITO Python module for atomistic visualization and analysis of structures and trajectories, including rendering, common-neighbor/PTM structure classification, coordination/RDF…. Ovito is an agent skill from JCLiuGroup/AI-Computational-Chemist. Use OVITO or the OVITO Python module for atomistic visualization and analysis of structures and trajectories, including rendering, common-neighbor/PTM structure classification, coordination/RDF, surface meshes, Wigner-Seitz defects, and trajectory-derived figures.

How do I install Ovito in Claude Code?

Run `npx skills add JCLiuGroup/AI-Computational-Chemist --skill ovito -a claude-code`. Or copy the skill folder (tools/ovito in JCLiuGroup/AI-Computational-Chemist) into .claude/skills/ovito in your project. Claude Code loads it when a task matches its description.

How do I install Ovito in Codex?

Run `npx skills add JCLiuGroup/AI-Computational-Chemist --skill ovito -a codex`. Or copy the skill folder (tools/ovito in JCLiuGroup/AI-Computational-Chemist) into .agents/skills/ovito in your project. Codex loads it when a task matches its description.

Can I use Ovito in Cursor, Gemini CLI or GitHub Copilot?

Cursor, Gemini CLI, GitHub Copilot and OpenCode also load SKILL.md folders. With the skills CLI, run `npx skills add JCLiuGroup/AI-Computational-Chemist --skill ovito -a cursor` (or -a gemini-cli, github-copilot or opencode for the others). To copy it by hand, put the folder in .cursor/skills/ovito, .gemini/skills/ovito, .github/skills/ovito and .opencode/skills/ovito in your project.

What does Ovito need to run?

Going by SKILL.md and its folder, Ovito needs Python for the scripts in its folder. Our summary lists: Python 3.

Does Ovito access the network?

SKILL.md contains no URLs. Any network use would come from the scripts or tools the agent runs. This is read from the text; nothing was executed.

Is Ovito safe to install?

Our automated static check of SKILL.md found no risky patterns, such as piping downloads into a shell, reading credential files or hidden Unicode. It is not a guarantee. The check reads SKILL.md only: the scripts in the folder are not scanned, so read them before running anything.

What licence does Ovito use?

Ovito has a licence file (the repository's licence) that doesn't match a standard licence. Read it on GitHub before reusing the skill.

How many tokens does Ovito use?

About 702 tokens (SKILL.md is roughly 2.8k characters). Agents keep only the skill's name and description in context until a task matches; then they load SKILL.md in full. Its references folder adds about 5.7k tokens, read only when the agent opens those files.

What are the alternatives to Ovito?

Skills that share tags, products or a category with Ovito: MCP Server Builder (anthropics/skills, 180k stars), PDF Processing (anthropics/skills, 180k stars), NotebookLM Research Assistant (PleasePrompto/notebooklm-skill, 7.8k stars) and Manim Video Production (browser-use/video-use, 28k stars). The comparison table on this page puts their stars, adoption, token cost, safety result and licence side by side.

Who maintains Ovito?

JCLiuGroup (a GitHub organization) maintains it in JCLiuGroup/AI-Computational-Chemist, which has 145 GitHub stars. The repository holds 21 skills in this directory. The repository was last updated on September 27, 2026.

Source: JCLiuGroup/AI-Computational-Chemist on GitHub. Facts on this page come from the repository at the commit we read; the author's words are quoted as theirs.