6 projects
dqclibs
Libraries for DQC
xitorch
Differentiable scientific computing library
dqc
Differentiable Quantum Chemistry
pylibxc2
PyLibxc is a python-bound C library of exchange and correlation functionals for density-functional (DFT) theory.
sunbear
Fast Monge-Ampere solver for n-dimensional arrays
anoa
A differentiable programming for scientists