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nanohub-simulator-interface

NanoHUB tool interface skill for accessing educational and research nanoscience simulations

不碰外部(只输出文字)无严重或高危命中a5c-ai/babysitter

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技能内容

NanoHUB Simulator Interface

Purpose

The NanoHUB Simulator Interface skill provides access to online nanoscience simulation tools from NanoHUB, enabling quick calculations and educational exploration of nanoscale phenomena.

Capabilities

  • Quantum dot simulations (NEMO)
  • CNT property calculators
  • Nanowire transport modeling
  • Band structure visualization
  • Interactive simulation execution
  • Result extraction and analysis

Usage Guidelines

NanoHUB Integration

  1. Tool Selection
  • Identify appropriate simulator
  • Understand input requirements
  • Check computational limits
  1. Simulation Execution
  • Submit jobs via API
  • Monitor progress
  • Retrieve results
  1. Analysis
  • Parse output files
  • Extract key parameters
  • Visualize results

Process Integration

  • Multiscale Modeling Integration
  • DFT Calculation Pipeline for Nanomaterials

Input Schema

{
  "tool_name": "string",
  "input_parameters": {},
  "execution_mode": "batch|interactive"
}

Output Schema

{
  "job_id": "string",
  "status": "completed|running|failed",
  "results": {},
  "output_files": ["string"],
  "execution_time": "number (seconds)"
}

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它属于哪个仓库

星标★ 1,796
本站分层T1
该仓技能数2115
原文件路径library/specializations/domains/science/nanotechnology/skills/nanohub-simulator-interface/SKILL.md

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