Sedimention of active Brownian particles in a box. Codes for numerical simulations and numerical solution of PDEs.
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Updated
Feb 11, 2024 - Python
Sedimention of active Brownian particles in a box. Codes for numerical simulations and numerical solution of PDEs.
Post-processing scripts for VASP output files, with focus on gnuplot formats
spider for arXiv, physical review, Nature and its subjournals
Calculation of thermal conductivity of graphene knot under strain
Fork of tight-binding python package developed by Sinisa Coh and David Vanderbilt.
A modification to the Custodian class in custodian (github.com/materialsproject/custodian) to allow for copying the temp_dir to other compute nodes via ssh.
Implementation of local algorithms within pyscf
Collection of tools for condensed matter computational physics.
GUI and engine for magnetic simulations
Software for visualising magnetic layers
BinPo: A code for electronic properties of 2D electron systems
A python package to calculate thermal conductivity across molecular interfaces.
Error propagation and statistical analysis for Markov chain Monte Carlo simulations in lattice QCD and statistical mechanics using autograd
Mirror of the Kwant project https://gitlab.kwant-project.org/kwant/kwant
Matbench: Benchmarks for materials science property prediction
Electronic structure Python package for post analysis and large scale tight-binding DFT/NEGF calculations
Course on topology in condensed matter
SchNetPack - Deep Neural Networks for Atomistic Systems
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