Pinned Repositories
adapt-vqe
ADAPT-VQE simulation code
CHEM6643
FermiCG
FermiCG-data
data for running TPSCI/BST/CMF type calculations.
group_website
nbody_tucker
OrbitalPartitioning
PauliOperators.jl
PyCMF
UnitaryPruning
nmayhall-vt's Repositories
nmayhall-vt/FermiCG
nmayhall-vt/adapt-vqe
ADAPT-VQE simulation code
nmayhall-vt/PauliOperators.jl
nmayhall-vt/nbody_tucker
nmayhall-vt/OrbitalPartitioning
nmayhall-vt/FermiCG-data
data for running TPSCI/BST/CMF type calculations.
nmayhall-vt/group_website
nmayhall-vt/PyCMF
nmayhall-vt/UnitaryPruning
nmayhall-vt/vt_theory_website
Theoretical Chemistry @ VT
nmayhall-vt/2024_faraday_discussions_data
nmayhall-vt/ActiveSpaceSolvers.jl
nmayhall-vt/BlockDavidson.jl
nmayhall-vt/ClusterMeanField.jl
nmayhall-vt/cookiecutter-qis
Python-centric Cookiecutter for Molecular QIS Packages
nmayhall-vt/ctrlVQE_Hessians
ctrl-VQE optimizations with Hessians
nmayhall-vt/ctrlVQEJulia
nmayhall-vt/DMET.jl
nmayhall-vt/fci
Full CI code in Julia
nmayhall-vt/InCoreIntegrals.jl
nmayhall-vt/molecool
nmayhall-vt/MonteCarlo
nmayhall-vt/psi4
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
nmayhall-vt/python-package-best-practices
http://nmayhall-vt.github.io/python-package-best-practices/
nmayhall-vt/QCBase.jl
Base level functions/types for quantum chemistry
nmayhall-vt/QuantumSoftware1
nmayhall-vt/RDM.jl
nmayhall-vt/rtd_test
nmayhall-vt/taylor_ucc
nmayhall-vt/vtq_website