45 lines
1.2 KiB
JSON
45 lines
1.2 KiB
JSON
{
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"id": "building-organic-molecules_task4",
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"snapshot": "avogadro",
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"instruction": "在 Avogadro 2 中，为甲苯分子执行几何优化。",
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"source": "custom",
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"config": [
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{
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"type": "launch",
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"parameters": {
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"command": [
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"C:\\Avogadro2\\bin\\avogadro2.exe"
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]
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}
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},
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{
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"type": "sleep",
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"parameters": {
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"seconds": 5
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}
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}
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],
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"trajectory": "trajectories/",
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"related_apps": [
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"avogadro"
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],
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"evaluator": {
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"postconfig": [
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{
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"type": "sleep",
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"parameters": {
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"seconds": 3
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}
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}
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],
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"func": "vllm_eval"
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},
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"proxy": false,
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"fixed_ip": false,
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"possibility_of_env_change": "low",
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"metadata": {
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"input_files": [],
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"steps": "1. 在当前激活的 Avogadro 2 主窗口中，按下键盘上的 Ctrl+Alt+O 组合键触发几何优化。\n2. 在主界面的 3D 渲染视图中，观察甲苯分子的空间结构变化。\n3. 等待分子的原子位置停止移动，确认其几何构型已优化至合理的化学结构。",
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"steps_original": "1. 按 Ctrl+Alt+O 或点击 Auto Optimize 工具执行几何优化。\n2. 检查分子是否获得合乎逻辑的几何结构。"
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}
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} |