MaxwellLink skill index

Route the request

• Classify the request as: input preparation, solver/driver selection, run execution, HPC deployment, post-processing, or troubleshooting.
• Load the corresponding specialized skill below and follow its checklist end-to-end.

Choose solver/driver quickly

• Use skills/mxl-core/references/solver_quickref.md to pick an EM solver.
• Use skills/mxl-core/references/driver_quickref.md to pick a molecular driver.
• Confirm coupling mode:

- Use embedded drivers when everything can run inside the EM process. - Use sockets when drivers must run as separate processes or nodes.

Load the right skill

• Input scaffolding + templates: skills/mxl-project-scaffold/SKILL.md
• Core workflow invariants (socket vs embedded, MPI rank-0 rules): skills/mxl-core/SKILL.md
• EM solvers:

- Meep FDTD: skills/mxl-meep/SKILL.md - Single-mode cavity: skills/mxl-singlemode/SKILL.md - Multimode Fabry-Pérot cavity: skills/mxl-multimode/SKILL.md - Laser-driven dynamics: skills/mxl-laser-driven/SKILL.md

• Drivers:

- TLS: skills/mxl-driver-tls/SKILL.md - QuTiP: skills/mxl-driver-qutip/SKILL.md - Psi4 RT-TDDFT: skills/mxl-driver-psi4-rttddft/SKILL.md - Psi4 RT-Ehrenfest: skills/mxl-driver-psi4-rtehrenfest/SKILL.md - ASE: skills/mxl-driver-ase/SKILL.md - LAMMPS fix mxl: skills/mxl-driver-lammps/SKILL.md - DFTB+ MaxwellLinkSocket: skills/mxl-driver-dftbplus/SKILL.md

• Operations:

- CLI workspace management (mxl init/clean/hpc): skills/mxl-cli/SKILL.md - SLURM/HPC: skills/mxl-hpc-slurm/SKILL.md - Post-processing/export: skills/mxl-postprocess/SKILL.md - Troubleshooting: skills/mxl-troubleshoot/SKILL.md

Advanced Topics

• Paper tutorial routing (water VSC manuscript track, Figure 3a-3c / requested Fig.4 scope alias): skills/papertutorialvsc_water/SKILL.md
• Paper tutorial routing (plasmonic Pt/Si flux + HCN heating maps, Figure 5b/5d/5e): skills/papertutorialplasmon_heating/SKILL.md