LatticeMind 0.4.0
LatticeMind is the AI agent for materials science from Nanoacademic. Describe the calculation you want in plain language, and LatticeMind plans the workflow, builds the crystal or device structure, generates and validates the solver inputs, runs the calculation locally or on your HPC cluster, and writes you a clear report — with the RESCU density functional theory solver at its core.
This manual walks you from installation to your first band structure, through every setting and interface, and on to advanced remote-execution and quantum transport workflows.
Note
RESCU is LatticeMind’s main solver and the best supported. With NanoDCAL you can run ground-state, electronic-structure, phonon and two-probe transport calculations, on your own machine or on an HPC cluster. Support for VASP is still in preview. This manual leads with RESCU and points out where the other solvers differ.