sevenel

sevenel's Stars

• BSKim12/Shift_current

  Code for calculate the shift current

  Language:Fortran3

• henriquemiranda/phononwebsite

  Visualise lattice vibrations

  Language:JavaScript8833

• jarvist/Julia-Phonons

  Julia codes to play with Phonons

  Language:Julia2211

• Frost-group/PolaronMobility.jl

  Feynman's variational path-integral model for the Fröhlich polaron. Calculates temperature dependent polaron mobilities, and other polaron observables.

  Language:Jupyter Notebook268

• huzongxiang/MatDGL

  MatDGL is a neural network package that allows researchers to train custom models for crystal modeling tasks. It aims to accelerate the research and application of material science.

  Language:Python6312

• PaulChern/LINVARIANT

  Language:Fortran218

• WMD-group/CarrierCapture.jl

  Julia package to compute trap-assisted electron and hole capture in semiconductors

  Language:Jupyter Notebook5224

• RedPointyJackson/Brooglie

  Solve the N-D time-independent Schrödinger equation for a single particle.

  Language:Julia92

• kbarbary/Dierckx.jl

  Julia package for 1-d and 2-d splines

  Language:Julia15730

• phonopy/phonopy

  Phonon code

  Language:Python357220

• pipidog/DFTtoolbox

  A toolbox for quickly build inputs and analyze results of DFT codes

  Language:Python3919

• jichunlian/disorder

  A code for generating irreducible site-occupancy configurations

  Language:Fortran4516

• QEF/q-e

  Mirror of the Quantum ESPRESSO repository. Please do not post Issues or pull requests here. Use gitlab.com/QEF/q-e instead.

  Language:Fortran569280

• jkitchin/dft-book

  A book on modeling materials using VASP, ase and vasp

  Language:Python352140

• WeibinChu/CA-NAC

  Concentric Approximation - Non-adiabatic Coupling

  Language:Python2115

• QijingZheng/Hefei-NAMD

  ab-initio nonadiabatic molecular dynamics program

  Language:Fortran9851

• goodluck1982/SpaceGroupIrep

  A mathematica package for irreducible representations of space group

  Language:Mathematica5320

• MaterSim/ComputationalPhysics300

  computational physics class taught at UNLV (Phys300)

  Language:Jupyter Notebook112123

• hackingmaterials/amset

  Electronic transport properties from first-principles calculations

  Language:Python13545

• mxchen-2020/kproj

  KPROJ: A Band Unfolding Program

  Language:Fortran3517

• Chengcheng-Xiao/VASP_OPT_AXIS

  Fix lattice component(s) during relaxation in VASP

  10537

• afonari/emc

  Effective Mass Calculator for Semiconductors

  Language:Python10359

• Chengcheng-Xiao/mpiPyMC

  A python based, MPI enabled, Monte-Carlo calculation of 2D system using Metropolis algorithm.

  Language:Python3415

• coudertlab/elate

  ELATE: Elastic tensor analysis

  Language:Jupyter Notebook7037

• Chengcheng-Xiao/VASP2WAN90_v2_fix

  An updated version of the VASP2WANNIER90v2 interface

  Language:Fortran8837