Alternatives and similar repositories for PluginPlay

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

• NWChemEx / TAMM
  Tensor Algebra for many-body methods
  ☆19Updated this week
• wavefunction91 / ExchCXX
  Exchange correlation (XC) library for density functional theory (DFT) calculations in modern C++
  ☆22Updated last month
• ExaChem / exachem
  Open Source Exascale Quantum Chemistry Software
  ☆28Updated last week
• simint-chem / simint-generator
  Code generator for simint vectorized integrals
  ☆28Updated 2 years ago
• ebylaska / PWDFT
  Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software
  ☆14Updated 2 weeks ago
• Yang-Laboratory / losc
  Library for local orbital scaling correction (LOSC).
  ☆16Updated last year
• MRChemSoft / mrcpp
  MultiResolution Computation Program Package
  ☆12Updated 5 months ago
• MRChemSoft / mrchem
  MultiResolution Chemistry
  ☆34Updated last week
• wavefunction91 / MACIS
  A modern C++ library for high-performance configuration interaction methods
  ☆18Updated 2 months ago
• wavefunction91 / GauXC
  GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …
  ☆36Updated 2 weeks ago
• nomad-coe / greenX
  Library for Green’s function based electronic structure theory calculations
  ☆26Updated 4 months ago
• wavefunction91 / scalapackpp
  C++17 Wrapper for ScaLAPACK
  ☆11Updated last year
• lanl / LATTE
  Developer repository for the LATTE code
  ☆46Updated 5 months ago
• rpep / fmmgen
  Automatic code generation of Fast Multipole and Barnes-Hut operators
  ☆18Updated 2 years ago
• RMGDFT / rmgdft
  RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…
  ☆50Updated this week
• roman-ellerbrock / QuTree
  A C++ linear algebra algebra focusing on tensor tree classes designed for quantum dynamics simulations and machine learning applications
  ☆18Updated last year
• filippolipparini / ddPCM
  A fast domain decomposition based implementation of the COSMO solvation model
  ☆15Updated 5 years ago
• LLNL / inq
  This is a mirror. Please check our main website on gitlab.
  ☆28Updated last week
• f-fathurrahman / ffr-PWDFT
  A poor man's density functional theory program
  ☆13Updated 10 months ago
• ifilot / hfcxx
  Hartree-Fock C++ code
  ☆32Updated last year
• sissaschool / turborvb
  Quantum Monte Carlo package, TurboRVB
  ☆31Updated last month
• lanl / qmd-progress
  PROGRESS: Parallel, Rapid O(N) and Graph-based Recursive Electronic Structure Solver.
  ☆26Updated this week
• psi-rking / optking
  optking: A molecular geometry optimization program
  ☆23Updated last month
• ORNL-QCI / ExaTENSOR
  Basic numerical tensor algebra library for distributed heterogeneous HPC platforms
  ☆17Updated 2 years ago
• PCMSolver / pcmsolver
  An API for the Polarizable Continuum Model
  ☆35Updated 2 years ago
• aoleynichenko / EXP-T
  The EXP-T program package is designed for high-precision modeling of molecular electronic structure using the relativistic Fock space mul…
  ☆18Updated 3 months ago
• dftlibs / xcfun
  XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives
  ☆61Updated 2 years ago
• DoNOF / DoNOFsw
  Donostia Natural Orbital Functional Software
  ☆20Updated 3 weeks ago
• NWChemEx / NWChemEx
  A top-level, user-focused, conglomerate repo for the NWChemEx project.
  ☆13Updated last month
• UFParLab / aces4
  Parallel Computational Chemistry Application
  ☆18Updated 8 years ago