charge-transport
There are 0 repository under charge-transport topic.
- chgnet
CederGroupHub / chgnet
Pretrained universal neural network potential for charge-informed atomistic modeling https://chgnet.lbl.gov
Language:Python 216 - SolidStateDetectors.jl
JuliaPhysics / SolidStateDetectors.jl
Solid state detector field and charge drift simulation in Julia
Language:Julia 76 - Language:C++ 44
- QC_Tools
JoshuaSBrown / QC_Tools
This small repository provides functionality for calculating the charge transfer integrals between two molecules.
Language:C++ 28 HoyLab-Rowan / RUQT
Fortran code for performing Landauer NEGF calculations using advanced electronic structure methods particularly parametric 2-RDM (NEGF-RDM) and multi-configuration pair density functional theory (NEGF-MCPDFT).
Language:Fortran 7Modular Python Code for Multiconfigurational Non-Equilibrium Green's Function Methodologies
Language:Python 3- Language:Julia 2
EPHoy-QC / RUQT_beta
Fortran code for performing Landauer NEGF calculations using advanced electronic structure methods particularly parametric 2-RDM (NEGF-RDM) and multi-configuration pair density functional theory (NEGF-PDFT).
Language:Fortran 0jbajars / ExactPolarobreathers
Numerical algorithms to study spectral properties of numerically exact stationary and moving polarobreathers
Language:MATLAB 0
