Awesome Open Source
Search
Programming Languages
Languages
All Categories
Categories
About

Search results for density chemistry

chemistry x
density x
9 search results found
Thermo ⭐ 517
Thermodynamics and Phase Equilibrium component of Chemical Engineering Design Library (ChEDL)
Chemics ⭐ 151
A Python package for chemical engineering
Quick ⭐ 118
QUICK: A GPU-enabled ab intio quantum chemistry software package
Py_xdh ⭐ 45
Document and code of python and PySCF approach XYG3 type of density functional 2nd-derivative realization
Neuralxc ⭐ 24
Implementation of a machine learned density functional
Kgrid ⭐ 15
Calculate the required k-point density from the input geometry for periodic quantum chemistry calculations
Apdft ⭐ 13
APDFT calculates quantumchemical results for many molecules at once.
Qc Dmet ⭐ 13
QC-DMET: a python implementation of density matrix embedding theory for ab initio quantum chemistry
Qc_pymol ⭐ 10
Scripts for using pymol together with quantum chemistry programs
Related Searches
Python Density (785)
Python Chemistry (483)
Jupyter Notebook Density (257)
R Density (198)
C Plus Plus Density (192)
Javascript Density (190)
Quantum Chemistry (176)
1-9 of 9 search results
Privacy | About | Terms | Follow Us On Twitter

Copyright 2018-2024 Awesome Open Source.  All rights reserved.