Agent SkillsCai-aa/CAE-Agent-Hub › ovito-evidence-postprocessing

ovito-evidence-postprocessing

GitHub

用于LAMMPS轨迹等粒子数据的OVITO后处理,构建可视化管道,生成渲染证据(图像/动画),区分原生输出与替代方案。

Skill/ovito/ovito-evidence-postprocessing/SKILL.md Cai-aa/CAE-Agent-Hub

Trigger Scenarios

需要可视化分子动力学模拟结果 生成原子级数据的渲染证据或动画 配置OVITO管道以展示应变或缺陷

Install

npx skills add Cai-aa/CAE-Agent-Hub --skill ovito-evidence-postprocessing -g -y
More Options

Non-standard path

npx skills add https://github.com/Cai-aa/CAE-Agent-Hub/tree/main/Skill/ovito/ovito-evidence-postprocessing -g -y

Use without installing

npx skills use Cai-aa/CAE-Agent-Hub@ovito-evidence-postprocessing

指定 Agent (Claude Code)

npx skills add Cai-aa/CAE-Agent-Hub --skill ovito-evidence-postprocessing -a claude-code -g -y

安装 repo 全部 skill

npx skills add Cai-aa/CAE-Agent-Hub --all -g -y

预览 repo 内 skill

npx skills add Cai-aa/CAE-Agent-Hub --list

SKILL.md

Frontmatter
{
    "name": "ovito-evidence-postprocessing",
    "description": "Evidence-first OVITO atomistic postprocessing for LAMMPS trajectories and other particle data, including pipeline construction, modifiers, coloring, clipping, camera setup, images, animations, tables, and state files. Use when Codex must inspect or present molecular-dynamics results while distinguishing OVITO Basic GUI availability from ovitos\/external Python automation and separating rendering evidence from upstream solver evidence."
}

OVITO Evidence Postprocessing

OVITO explains and renders atomistic data; it does not prove that the upstream simulation was physically correct.

Start

ai-cae-toolbox context-scope --solver ovito
ai-cae-toolbox bridge-plan --solver ovito --objective "<objective>"
ai-cae-toolbox create-run --solver ovito --case <case-name> --objective "<objective>"
ai-cae-toolbox write-smoke-template --solver ovito --run-dir <run-dir>

Use ovito_check_installation before scripting. OVITO Basic may include ovito.exe but not ovitos; configure a compatible external Python with the OVITO package when batch scripting is required.

Build the Pipeline

Record input trajectory, frame range, particle properties, modifiers and their parameters, selection/deletion rules, color mapping, clipping plane, camera, render size, background, and export interval.

For strain or defect visualizations, record the reference configuration, neighbor cutoff, crystal structure, and modifier assumptions. Read references/render-evidence.md.

Finish

Export the pipeline script, PNG/MP4, numeric table when available, and a short caption defining every color and scalar range. State whether the output came from OVITO, a compatible Python implementation, or another plotting library. Never label a substitute plot as native OVITO output.

Version History

  • fc7b93e Current 2026-08-16 09:00

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2026-08-16 09:00

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