Jon Bender's repositories

spectroscopy-scripts

Scripts for convenient work with the time-resolved transient absorption data: graphing, non-exponential kinetic analysis

Language:Jupyter NotebookLicense:GPL-3.0Stargazers:1Issues:0Issues:0

academicpages.github.io

Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes

License:MITStargazers:0Issues:0Issues:0

AI_ENERGIES

Ab Initio Energies

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aiida-vasp

A plugin to AiiDA for running simulations with VASP

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crystaltoolkit

Crystal Toolkit is an interactive web app that allows you to import, view, analyze and transform crystal structures and molecules. It is also a suite of ready-made UI components to render Materials Project data using the Dash framework from Plotly.

License:NOASSERTIONStargazers:0Issues:0Issues:0

cython

The most widely used Python to C compiler

License:Apache-2.0Stargazers:0Issues:0Issues:0

DFTAtom

Density Functional Theory in real space, for atoms

Language:C++License:GPL-3.0Stargazers:0Issues:1Issues:0

lammps

Public development project of the LAMMPS MD software package

License:GPL-2.0Stargazers:0Issues:0Issues:0

libint

Libint is a high-performance library for computing Gaussian integrals in quantum mechanics

License:NOASSERTIONStargazers:0Issues:0Issues:0

magenta

Magenta: Music and Art Generation with Machine Intelligence

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mainline

The mainline development distribution for QWalk

License:GPL-2.0Stargazers:0Issues:0Issues:0

meep

free finite-difference time-domain (FDTD) software for electromagnetic simulations

License:GPL-2.0Stargazers:0Issues:0Issues:0

NISE_2017

This is the current development version of a quantum classical package for calculating coherent multidimensional spectra (as FTIR, SFG, 2DIR, 2DES, 2DSFG, and F-2DES).

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nomad

Multi-state Dynamics using Trajectory Basis Functions

License:LGPL-3.0Stargazers:0Issues:0Issues:0

numpy

The fundamental package for scientific computing with Python.

License:BSD-3-ClauseStargazers:0Issues:0Issues:0

OFC-Spectroscopy

Second and third order NL-Polarization Calculations

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opem

OPEM (Open Source PEM Fuel Cell Simulation Tool)

License:MITStargazers:0Issues:0Issues:0

OpenFermion

The electronic structure package for quantum computers.

License:Apache-2.0Stargazers:0Issues:0Issues:0

openmm

OpenMM is a toolkit for molecular simulation using high performance GPU code.

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psi4

Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

License:LGPL-3.0Stargazers:0Issues:0Issues:0

pyqmc

Python library for real space quantum Monte Carlo

License:MITStargazers:0Issues:0Issues:0

pyscf

Python module for quantum chemistry

License:Apache-2.0Stargazers:0Issues:0Issues:0

scikit-image

Image processing in Python

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SHTOOLS

SHTOOLS - Spherical Harmonic Tools

License:BSD-3-ClauseStargazers:0Issues:0Issues:0

silx

ScIentific Library for eXperimentalists

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t3f

Tensor Train decomposition on TensorFlow

License:MITStargazers:0Issues:0Issues:0

TBTK

A C++ library for solving second-quantized Hamiltonians

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vispy

Main repository for Vispy

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West

WEST code for GitHub - mirror of http://greatfire.uchicago.edu/west-public/West

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westpy

WESTpy code for GitHub - mirror of http://greatfire.uchicago.edu/west-public/westpy

License:GPL-3.0Stargazers:0Issues:0Issues:0