Alternatives and similar repositories for PyDiatomic

Users that are interested in PyDiatomic are comparing it to the libraries listed below

• dean0x7d / pybinding
  Scientific Python package for tight-binding calculations in solid state physics
  ☆204Updated 2 years ago
• GkAntonius / feynman
  Sharp-looking Feynman diagrams in python
  ☆73Updated 10 months ago
• compas / grasp
  General Relativistic Atomic Structure Package
  ☆79Updated 2 months ago
• FelixDesrochers / Numerov
  A python script that solves the one dimensional time-independent Schrodinger equation for bound states. The script uses a Numerov method…
  ☆71Updated 4 years ago
• richard-evans / vampire
  Atomistic simulator for magnetic materials
  ☆144Updated last week
• computationalmodelling / fidimag
  Finite DIfference microMAGnetic code, based on Python, Cython and C
  ☆70Updated last month
• jakevdp / pySchrodinger
  A Python solver for the 1D Schrodinger equation
  ☆125Updated 5 years ago
• jameskermode / f90wrap
  F90 to Python interface generator with derived type support
  ☆267Updated last month
• fspiga / qe-gpu
  GPU-accelerated Quantum ESPRESSO using CUDA FORTRAN
  ☆65Updated 5 years ago
• hosilva / physrev_mplstyle
  A matplotlib style sheet to help me spend less time editing figures for my manuscripts for Phys. Rev. D.
  ☆30Updated 6 months ago
• VlachosGroup / renview
  The Reaction Network Viewer (ReNView) generates a graphic representation of the reaction fluxes within the system essential for identifyi…
  ☆22Updated last year
• maroba / multipoles
  A Python package for multipole expansions of electrostatic or gravitational potentials
  ☆44Updated 11 months ago
• phonopy / phono3py
  A simulation package of phonon-phonon interaction related properties
  ☆150Updated last week
• abinit / abinit
  The official github mirror of the Abinit repository. We welcome bug fixes and improvements. Note that most of the active developments are…
  ☆250Updated 3 months ago
• zhangqi-chen / pyDiffusion
  A Python library for diffusion simulation and data analysis
  ☆27Updated 6 years ago
• EDRIXS / edrixs
  An open source toolkit for simulating RIXS spectra based on ED
  ☆35Updated 3 weeks ago
• pyiron / executorlib
  Up-scale python functions for high-performance computing (HPC)
  ☆57Updated last week
• python-periodictable / periodictable
  Extensible periodic table for python
  ☆163Updated 8 months ago
• jameskermode / AtomEye
  Modified fork of Ju Li's atomistic configuration viewer (http://li.mit.edu/Archive/Graphics/A/)
  ☆31Updated 8 years ago
• SYalouz / QuantNBody
  QuantNBody : a python package for quantum chemistry/physics to manipulate many-body operators and wave functions.
  ☆14Updated 8 months ago
• abinit / abipy
  Open-source library for analyzing the results produced by ABINIT
  ☆132Updated last month
• materialsproject / MPWorks
  merges pymatgen, custodian, and FireWorks into a custom workflow for Materials Project
  ☆24Updated 6 years ago
• TRIQS / triqs
  A Toolbox for Research on Interacting Quantum Systems. Supported by the Flatiron Institute.
  ☆167Updated last week
• bjmorgan / lattice_mc
  Lattice gas Monte Carlo simulation code
  ☆35Updated 5 years ago
• numfys / numfys
  A resource for use of numerical physics with Python, covering many topics in physics.
  ☆35Updated 3 years ago
• OpenJAC / JenaAtomicCalculator.jl
  Jena Atomic Calculator
  ☆124Updated last week
• ncrump / ComputationalPhysics
  A survey of computational physics problems in Python. Includes quantum mechanics, electrostatics, ODEs, PDEs, Monte Carlo, Fourier analy…
  ☆60Updated 10 years ago
• abinit / pseudo_dojo
  Python framework for generating and validating pseudo potentials
  ☆49Updated 2 years ago
• mholtrop / QMPython
  Quantum Mechanics and Schrodinger Equation Solvers in Python.
  ☆59Updated 4 years ago
• QEF / q-e_old
  Official mirror of Quantum ESPRESSO
  ☆47Updated 7 years ago