qimpy

QimPy: Quantum-Integrated Multi-PhYsics

Classes

TreeNode	Base class of objects in tree for construction and checkpointing.
Energy	Energy of system with access to components

Modules

rc	Run configuration / hardware resources.
profiler	High-level profiling utilities.
io	I/O functionality including checkpoints and logging.
mpi	MPI communication utilities.
math	Math functions extending the core torch set.
algorithms	Shared algorithms for optimization and self-consistency.
lattice	Bravais lattice and unit cell
symmetries	Point- and space-group detection and enforcement
grid	Grids, fields and their operations
dft	Electronic density-functional theory.
transport