evangelistalab / fortecubeviewView external linksLinks
A simple cube file viewer based on pythreejs
☆25Sep 4, 2023Updated 2 years ago
Alternatives and similar repositories for fortecubeview
Users that are interested in fortecubeview are comparing it to the libraries listed below
Sorting:
- A Python script for rendering cube files generated by Psi4☆19Mar 30, 2025Updated 10 months ago
- Library for local orbital scaling correction (LOSC).☆17Jul 4, 2024Updated last year
- PyCC is a simple, Python-based, reference implementation of the coupled cluster method of ab initio quantum chemistry.☆57Jan 10, 2026Updated last month
- OpenRSP: open-ended response theory.☆16Aug 16, 2020Updated 5 years ago
- A fast domain decomposition based implementation of the COSMO solvation model☆16Jun 15, 2020Updated 5 years ago
- An open-source library for reduced-density matrix-based analysis and computation☆20Apr 2, 2023Updated 2 years ago
- Cornell-Holland Ab-initio Materials Package☆17Aug 10, 2024Updated last year
- optking: A molecular geometry optimization program☆26Aug 22, 2025Updated 5 months ago
- Fast computation of a gaussian and its derivative on a grid.☆31Sep 26, 2025Updated 4 months ago
- Reusable DFT Grids for the Masses☆19Feb 6, 2026Updated last week
- gammcor code☆11Sep 25, 2025Updated 4 months ago
- Python version of Grimme's D3-dispersion correction for compchem inputs/outputs☆19Updated this week
- Donostia Natural Orbital Functional Software☆22Feb 9, 2026Updated last week
- ☆60Jun 30, 2025Updated 7 months ago
- Dyson equation solvers for Green's function methods☆11Feb 10, 2026Updated last week
- Multi-collinear functional☆10Mar 2, 2025Updated 11 months ago
- ☆15Dec 4, 2025Updated 2 months ago
- A C++ library for the efficient evaluation of integrals over effective core potentials.☆28Jun 12, 2024Updated last year
- A Python package for wave function-based quantum embedding☆39Jan 20, 2026Updated 3 weeks ago
- SOC integrals generator with atomic mean field approximation☆10Jul 11, 2025Updated 7 months ago
- GauXC is a modern, modular C++ library for the evaluation of quantities related to the exchange-correlation (XC) energy (e.g. potential, …☆46Feb 6, 2026Updated last week
- Basis set optimization library for quantum chemistry☆36Jun 27, 2025Updated 7 months ago
- Libint2 interface to Julia☆14Sep 10, 2020Updated 5 years ago
- Program for Molecular Fock Dirac calculations☆12Apr 16, 2020Updated 5 years ago
- Molecular frequency-dependent response properties for arbitrary operators☆11Feb 9, 2026Updated last week
- A variational 2-RDM-driven CASSCF plugin to Psi4☆11Mar 10, 2021Updated 4 years ago
- MPI parallelization for PySCF☆34Nov 1, 2024Updated last year
- A C++ library for evaluating non-orthogonal matrix elements in electronic structure☆28Feb 19, 2025Updated 11 months ago
- C++ library for the implementation of tensor product calculations through a clean, concise user interface.☆26Aug 22, 2023Updated 2 years ago
- Calculate the dispersion energy and related quantities in gas-phase systems using the exchange-hole dipole moment (XDM) model.☆23May 29, 2025Updated 8 months ago
- ☆16Dec 11, 2025Updated 2 months ago
- Learning Machine Learning☆14Aug 24, 2023Updated 2 years ago
- XCFun: A library of exchange-correlation functionals with arbitrary-order derivatives☆61Nov 30, 2022Updated 3 years ago
- Correlation consistent Gaussian basis sets for solids☆25May 31, 2025Updated 8 months ago
- TREX I/O library☆64Feb 10, 2026Updated last week
- Parallel Computational Chemistry Application☆18Aug 31, 2017Updated 8 years ago
- ☆13Jan 21, 2026Updated 3 weeks ago
- Arrow - Fast Semistochastic Heat Bath Configuration Interaction Solver (SHCI)☆34Oct 27, 2025Updated 3 months ago
- Code generator for simint vectorized integrals☆29Mar 16, 2023Updated 2 years ago