First-response triage for cross-code (LAMMPS/VASP/QE/MOOSE) simulation failures: classifies the failure signature (nonconvergence, NaN/Inf, exploding energy, unstable timestep, pressure blow-up, missing potentials/pseudopotentials, memory exhaustion, process crash/segfault, corrupted output, incomplete runs) and proposes a SAFE one-change-at-a-time RETRY LADDER with explicit STOP CONDITIONS…
Install
npx skills add HeshamFS/materials-simulation-skills --skill simulation-failure-triagenpx skills add HeshamFS/materials-simulation-skills --skill simulation-failure-triage -a claude-code -gnpx skills add HeshamFS/materials-simulation-skills --skill simulation-failure-triage -a codex -ggemini skills install https://github.com/HeshamFS/materials-simulation-skills.git --path skills/robustness/simulation-failure-triagegh skill install HeshamFS/materials-simulation-skills simulation-failure-triagegit clone --depth 1 https://github.com/HeshamFS/materials-simulation-skills /tmp/HeshamFS__materials-simulation-skills
mkdir -p ~/.claude/skills ~/.agents/skills
cp -R /tmp/HeshamFS__materials-simulation-skills/skills/robustness/simulation-failure-triage ~/.claude/skills/simulation-failure-triage # Claude Code
cp -R /tmp/HeshamFS__materials-simulation-skills/skills/robustness/simulation-failure-triage ~/.agents/skills/simulation-failure-triage # Codex, Cursor, Gemini CLI, Copilot, OpenCode