Alternatives and similar repositories for ElectronVisualized

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

• jeanwsr / awesome-qc-courses
  Quantum Chemistry course resources available on github and other platforms
  ☆53Updated 2 years ago
• geem-lab / overreact
  ⚛️📈 Create and analyze chemical microkinetic models built from computational chemistry data. Crafted at the @geem-lab.
  ☆61Updated last week
• andeplane / atomify
  Real time molecular dynamics in the browser using LAMMPS
  ☆71Updated last week
• jjgoings / pade
  do the Fourier transform using the method of Padé approximants
  ☆23Updated last year
• GOMC-WSU / GOMC
  GOMC - GPU Optimized Monte Carlo is a parallel molecular simulation code designed for high-performance simulation of large systems
  ☆85Updated 2 months ago
• subblue / applying-maths-book
  Applying Maths in the Chemical and Biomolecular Sciences by Godfrey Beddard
  ☆16Updated 6 months ago
• kszenes / MementoChem
  The Input Generator for Forgetful Chemists 🤓
  ☆13Updated 6 months ago
• aromanro / PythonCompphys
  Some python workbooks with various topics from Computational Physics
  ☆64Updated 2 years ago
• mala-project / mala
  Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.
  ☆98Updated last month
• nmardirossian / PySCF_Tutorial
  ☆31Updated 7 years ago
• pyiron / pyiron_atomistics
  pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
  ☆47Updated this week
• dylanljones / lattpy
  Simple and efficient Python package for modeling d-dimensional Bravais lattices in solid state physics.
  ☆45Updated 2 weeks ago
• jkitchin / dft-book-espresso
  New version of dft-book for Quantum Espresso
  ☆47Updated 5 years ago
• metatensor / metatensor
  Self-describing sparse tensor data format for atomistic machine learning and beyond
  ☆93Updated this week
• lmmentel / chemtools
  Python tools for quantum chemical calculations
  ☆21Updated 2 years ago
• materialsproject / jobflow
  jobflow is a library for writing computational workflows.
  ☆117Updated this week
• kthpanor / echem
  eChem: Jupyter book on theoretical chemistry
  ☆111Updated 3 months ago
• radi0sus / orca_ir
  Plots IR spectra from from ORCA output files
  ☆22Updated last year
• Open-Quantum-Platform / openqp
  The main repository of Open Quantum Platform (OpenQP) maintained by Choi Group at KNU.
  ☆47Updated 2 weeks ago
• semodi / neuralxc
  Implementation of a machine learned density functional
  ☆36Updated last year
• giovannipizzi / SchrPoisson-2DMaterials
  A Schrödinger-Poisson solver for 2D materials with 1D interfaces (wires)
  ☆21Updated 4 years ago
• aromanro / HartreeFock
  A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaus…
  ☆68Updated last month
• khavernathy / mcmd
  Monte Carlo and Molecular Dynamics Simulation Package
  ☆93Updated last year
• USCCACS / RXMD
  RXMD : Linear-Scaling Parallel Reactive Molecular Dynamics Simulation Engine
  ☆26Updated last month
• BingqingCheng / ML-in-chemistry-101
  The course materials for "Machine Learning in Chemistry 101"
  ☆84Updated 5 years ago
• selimsami / qforce
  ☆61Updated 6 months ago
• cagrikymk / JAX-ReaxFF
  JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields
  ☆74Updated last year
• chrisjsewell / ase-notebook
  Highly configurable 2D (SVG) & 3D (threejs) visualisations for ASE/Pymatgen structures, within the Jupyter Notebook.
  ☆35Updated 3 years ago
• aspuru-guzik-group / funsies
  funsies is a lightweight workflow engine 🔧
  ☆41Updated 4 years ago
• materialsproject / pyrho
  ☆42Updated last week