Generate Plotly-compatible reaction energy diagrams from Gibbs energies.
npx skills add https://github.com/Hello-QM/catgo-LRG --skill energy-diagram
Please help me install this Agent Skill. Skill: energy-diagram Source: https://github.com/Hello-QM/catgo-LRG/tree/main/.claude/skills/energy-diagram Command: npx skills add https://github.com/Hello-QM/catgo-LRG --skill energy-diagram
Generates Plotly-compatible reaction energy pathway diagrams from computed intermediate and transition-state energies, enabling clear visualization of reaction mechanisms.
Provide Gibbs energy values from upstream nodes to render a Plotly energy diagram.
High-intent search queries and answers about installing and using this skill.
To plot a reaction energy pathway diagram, provide computed Gibbs energies from intermediates and transition states to automatically generate Plotly-compatible figures with labeled intermediates and cubic-spline curves.
Yes, you can compare multiple catalytic reaction pathways such as OER, HER, CO2RR, and NRR in a single visualization, generating publication-ready figures with multi-path comparisons and transition state arches.
Generating a reaction energy diagram for catalysis studies requires Gibbs energy values derived from upstream geometry optimization and frequency analysis, which are processed to visualize transition states and reaction intermediates.
Yes, the energy diagram visualization supports transition states by rendering them with dashed connectors and cubic-spline curves, accurately mapping the reaction pathway alongside intermediate energy levels.
The best way to create publication-ready energy pathway figures is to input computed Gibbs energies into the workflow, which renders Plotly-compatible diagrams with labeled intermediates and transition state arches for catalysis studies.
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