OmniRoute Routing CLI
diegosouzapw/OmniRoute
Creates, switches, and inspects OmniRoute model-routing combos, plus a suggestion command with cost and latency constraints.
Route VASP DFT requests to task-specific subskills based on user intent.
LGPL-3.0-or-laterAuto-check passed
Install Dft Vasp
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a claude-codeProject install by default; add -g for ~/.claude/skills/.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vasp --agent claude-codeProject scope by default; add --scope user for a personal install. Needs GitHub CLI 2.90.0 or later (public preview).
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .claude/skills && cp -r skills-src/quantum-chemistry/dft-vasp .claude/skills/dft-vasp && rm -rf skills-srcUse ~/.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/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .claude/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.Claude Code copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
$skill-installer install https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vaspType this inside Codex. $skill-installer <name> installs a curated skill from openai/skills. The installer writes to $CODEX_HOME/skills (default ~/.codex/skills). Restart Codex if the skill does not show up.
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a codexProject install goes to .agents/skills/; add -g for ~/.codex/skills/.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vasp --agent codexProject scope by default (.agents/skills/); add --scope user for a personal install.
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .agents/skills && cp -r skills-src/quantum-chemistry/dft-vasp .agents/skills/dft-vasp && rm -rf skills-srcUse ~/.agents/skills/ instead of .agents/skills for a personal install.
Codex skills documentation · loads skills from .agents/skills/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .agents/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.Codex copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a cursorProject install goes to .agents/skills/; add -g for ~/.cursor/skills/.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vasp --agent cursorProject scope by default (.agents/skills/); add --scope user for a personal install.
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .cursor/skills && cp -r skills-src/quantum-chemistry/dft-vasp .cursor/skills/dft-vasp && rm -rf skills-srcUse ~/.cursor/skills/ instead of .cursor/skills for a personal install.
Cursor skills documentation · loads skills from .cursor/skills/, .agents/skills/, .claude/skills/, .codex/skills/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .cursor/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.Cursor copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
$ gemini skills install https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git --path quantum-chemistry/dft-vasp--scope user (default) or --scope workspace; --path is the subfolder of the repo that holds the skill; --consent skips the security confirmation prompt.
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a gemini-cliProject install goes to .agents/skills/; add -g for ~/.gemini/skills/.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vasp --agent gemini-cliProject scope by default (.agents/skills/); add --scope user for a personal install.
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .gemini/skills && cp -r skills-src/quantum-chemistry/dft-vasp .gemini/skills/dft-vasp && rm -rf skills-srcUse ~/.gemini/skills/ instead of .gemini/skills for a personal install, then run /skills reload.
Gemini CLI skills documentation · loads skills from .gemini/skills/, .agents/skills/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .gemini/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.Gemini CLI copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vaspInstalls for Copilot at project scope by default; add --scope user for a personal install. Preview a skill first with gh skill preview. Needs GitHub CLI 2.90.0 or later (public preview).
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a github-copilotProject install goes to .agents/skills/; add -g for ~/.copilot/skills/.
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .github/skills && cp -r skills-src/quantum-chemistry/dft-vasp .github/skills/dft-vasp && rm -rf skills-srcUse ~/.copilot/skills/ instead of .github/skills for a personal install. Commit .github/skills so cloud agent and code review can use it.
GitHub Copilot skills documentation · loads skills from .github/skills/, .claude/skills/, .agents/skills/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .github/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.GitHub Copilot copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
$ npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a opencodeOpenCode documents no install command of its own. Project install goes to .agents/skills/; add -g for ~/.config/opencode/skills/.
$ gh skill install jinzhezenggroup/computational-chemistry-agent-skills dft-vasp --agent opencodeProject scope by default (.agents/skills/); add --scope user for a personal install.
$ git clone --depth 1 https://github.com/jinzhezenggroup/computational-chemistry-agent-skills.git skills-src && mkdir -p .opencode/skills && cp -r skills-src/quantum-chemistry/dft-vasp .opencode/skills/dft-vasp && rm -rf skills-srcUse ~/.config/opencode/skills/ instead of .opencode/skills for a personal install.
OpenCode skills documentation · loads skills from .opencode/skills/, .claude/skills/, .agents/skills/
Install the "dft-vasp" agent skill from https://github.com/jinzhezenggroup/computational-chemistry-agent-skills/tree/master/quantum-chemistry/dft-vasp into .opencode/skills/dft-vasp/ in this project. Copy the whole folder (SKILL.md and every file beside it), keep the folder name "dft-vasp", then confirm the skill loads.OpenCode copies the folder itself, the same result as the manual copy. Check what it changed before you commit it.
Facts
- Skill name
dft-vasp- GitHub stars
- 148
- Token cost
- ~602 tokens
- SKILL.md length
- 229 words
- Files
- 2 (incl. references)
- Skills in repo
- 62
- Repo updated
- First seen
- Licence
- LGPL-3.0-or-later
At a glance
Route VASP DFT requests to task-specific subskills based on user intent.
- Works in 5 steps: If user requests single-point… → If user requests geometry optimization:… → If user requests density of states… → …
- The user asks for VASP workflows and you must decide between static SCF
- SKILL.md covers Purpose, Scope, Hard requirement and Routing rules, plus 2 more sections
- Instructions only: no scripts, shell commands, URLs or credentials in SKILL.md
What it does
Dft Vasp is an agent skill from jinzhezenggroup/computational-chemistry-agent-skills. Route VASP DFT requests to task-specific subskills based on user intent. Use when the user asks for VASP workflows and you must decide between static SCF, relaxation, DOS, or band-structure task preparation. This orchestration skill does not own detailed input generation logic; it dispatches to the correct VASP subskill and enforces consistent handoff to submission skills.
Its SKILL.md is about 600 tokens, which your agent loads only when the skill is triggered. The skill folder holds 2 other files, including reference files (for example `references/commands-and-workflow.md`). Compatibility notes: Requires a user-provided structure and valid VASP pseudopotential resources/license in the target environment.
The repository describes itself as: Agent skills to run computational-chemistry tasks, used in OpenClaw. The licence is LGPL-3.0-or-later.
When your agent uses it
- The user asks for VASP workflows and you must decide between static SCF
- Band-structure task preparation
Example prompts
- “/dft-vasp”
Requirements
- Compatibility (from SKILL.md): Requires a user-provided structure and valid VASP pseudopotential resources/license in the target environment.
Workflow steps
5 steps, taken from the first numbered list in SKILL.md.
- If user requests single-point energy/electronic SCF: route to dft-vasp/static.
- If user requests geometry optimization: route to dft-vasp/relax.
- If user requests density of states workflow: route to dft-vasp/dos.
- If user requests band-structure workflow: route to dft-vasp/band.
- If intent is ambiguous, ask one focused clarification question before routing.
What it can do on your machine
Read from SKILL.md and the folder at commit 5c19e75. 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
No scripts in the folder and no shell commands in SKILL.md.
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.
Compatibility
Requires a user-provided structure and valid VASP pseudopotential resources/license in the target environment.
From compatibility in the SKILL.md frontmatter.
Context cost
Dft Vasp loads about 602 tokens when it runs, and up to ~824 if it reads all its reference files. Until then it costs about 96 tokens; SKILL.md has 229 words of instructions outside code blocks.
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); files beside SKILL.md are not scanned.
SKILL.md
The full file from jinzhezenggroup/computational-chemistry-agent-skills at commit 5c19e75, republished under its LGPL-3.0-or-later licence (© jinzhezenggroup). 229 words, ~602 tokens.
Download SKILL.mdSave it as
.claude/skills/dft-vasp/SKILL.md (or your agent's skills folder). This skill also uses 1 other file; get the full folder from GitHub.- name
- dft-vasp
- description
- Route VASP DFT requests to task-specific subskills based on user intent. Use when the user asks for VASP workflows and you must decide between static SCF, relaxation, DOS, or band-structure task preparation. This orchestration skill does not own detailed input generation logic; it dispatches to the correct VASP subskill and enforces consistent handoff to submission skills.
- compatibility
- Requires a user-provided structure and valid VASP pseudopotential resources/license in the target environment.
- license
- LGPL-3.0-or-later
- metadata.author
- qqgu
- metadata.version
- 0.2.0
- metadata.repository
- https://vasp.at/
VASP Task Router
Use this skill as the top-level VASP orchestration layer.
Purpose
This skill routes the request to one task-specific VASP subskill path:
dft-vasp/staticdft-vasp/relaxdft-vasp/dosdft-vasp/band
Scope
This router skill should:
- require a user-provided structure or prerequisite run artifacts
- classify user intent into one VASP task type
- collect only minimal shared context before dispatch
- delegate detailed parameter handling to the selected subskill
- enforce consistent output/handoff policy across subskills
This router skill should not:
- own full INCAR/KPOINTS templates for all tasks
- execute or submit calculations
- bypass task-specific guardrails
Hard requirement
The user must provide enough starting context:
- structure input for
static/relax - prerequisite SCF artifacts for
dos/bandwhen required
If prerequisites are missing, stop and ask for them.
Routing rules
- If user requests single-point energy/electronic SCF: route to
dft-vasp/static. - If user requests geometry optimization: route to
dft-vasp/relax. - If user requests density of states workflow: route to
dft-vasp/dos. - If user requests band-structure workflow: route to
dft-vasp/band. - If intent is ambiguous, ask one focused clarification question before routing.
Shared policy for all subskills
- do not invent pseudopotentials
- expose assumptions explicitly
- report unresolved scientific choices
- return handoff-ready task directory
- if execution is requested, hand off to
dpdisp-submit
Output from router
Provide:
- selected subskill name
- why it was selected
- minimal required inputs still missing (if any)
- explicit next step (invoke selected subskill)
© jinzhezenggroup, LGPL-3.0-or-later. Rendered from Markdown: HTML in the file is shown as text, images as links, and headings moved down two levels. Raw file
Files
SKILL.md and 1 other file (references) in quantum-chemistry/dft-vasp of jinzhezenggroup/computational-chemistry-agent-skills.
- SKILL.md
- references/commands-and-workflow.md
Open the folder on GitHubat commit 5c19e75
Compare with similar skills
Dft Vasp 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.
| Skill | Stars | Used in | Tokens | Auto-check | Licence | Repo updated |
|---|---|---|---|---|---|---|
| Dft Vasp this skilljinzhezenggroup/computational-chemistry-agent-skills | 148 | — | ~602 | Automated safety check: Pass | LGPL-3.0-or-later | |
| OmniRoute Routing CLIdiegosouzapw/OmniRoute | 75k | — | ~342 | Automated safety check: Pass | MIT | |
| OmniRoute Combo Routingdiegosouzapw/OmniRoute | 75k | — | ~2.1k | Automated safety check: Pass | MIT | |
| Intelligence Routeruvnet/ruflo | 74k | — | ~874 | Automated safety check: Notes | MIT | |
| SPA Routes and Featureslobehub/lobehub | 83k | — | ~3.5k | Automated safety check: Pass | Custom licence | |
| Routingalsk1992/CloddsBot | 3k | — | ~1.6k | Automated safety check: Pass | MIT |
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Questions about Dft Vasp
What does Dft Vasp do?
Route VASP DFT requests to task-specific subskills based on user intent. Dft Vasp is an agent skill from jinzhezenggroup/computational-chemistry-agent-skills. Route VASP DFT requests to task-specific subskills based on user intent.
When should I use Dft Vasp?
Dft Vasp fits situations like: the user asks for VASP workflows and you must decide between static SCF; band-structure task preparation.
How do I install Dft Vasp in Claude Code?
Run `npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a claude-code`. Or copy the skill folder (quantum-chemistry/dft-vasp in jinzhezenggroup/computational-chemistry-agent-skills) into .claude/skills/dft-vasp in your project. Claude Code loads it when a task matches its description.
How do I install Dft Vasp in Codex?
Run `npx skills add jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a codex`. Or copy the skill folder (quantum-chemistry/dft-vasp in jinzhezenggroup/computational-chemistry-agent-skills) into .agents/skills/dft-vasp in your project. Codex loads it when a task matches its description.
Can I use Dft Vasp 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 jinzhezenggroup/computational-chemistry-agent-skills --skill dft-vasp -a cursor` (or -a gemini-cli, github-copilot or opencode for the others). To copy it by hand, put the folder in .cursor/skills/dft-vasp, .gemini/skills/dft-vasp, .github/skills/dft-vasp and .opencode/skills/dft-vasp in your project.
What does Dft Vasp need to run?
SKILL.md names no scripts, command-line tools or credentials: Dft Vasp is instructions for the agent only. Compatibility (from SKILL.md): Requires a user-provided structure and valid VASP pseudopotential resources/license in the target environment..
Does Dft Vasp 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 Dft Vasp 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. Review the folder before installing.
What licence does Dft Vasp use?
Dft Vasp is published under the LGPL-3.0-or-later licence (declared in SKILL.md). It allows redistribution, so the full SKILL.md is shown on this page.
How many tokens does Dft Vasp use?
About 602 tokens (SKILL.md is roughly 2.4k 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 222 tokens, read only when the agent opens those files.
What are the alternatives to Dft Vasp?
Skills that share tags, products or a category with Dft Vasp: OmniRoute Routing CLI (diegosouzapw/OmniRoute, 75k stars), OmniRoute Combo Routing (diegosouzapw/OmniRoute, 75k stars), Intelligence Route (ruvnet/ruflo, 74k stars) and SPA Routes and Features (lobehub/lobehub, 83k stars). The comparison table on this page puts their stars, adoption, token cost, safety result and licence side by side.
Who maintains Dft Vasp?
jinzhezenggroup (a GitHub organization) maintains it in jinzhezenggroup/computational-chemistry-agent-skills, which has 148 GitHub stars. The repository holds 62 skills in this directory. The repository was last updated on October 9, 2026.
Source: jinzhezenggroup/computational-chemistry-agent-skills on GitHub. Facts on this page come from the repository at the commit we read; the author's words are quoted as theirs.