remove ORCA (#1687)

This commit is contained in:
Christopher Hillenbrand
2025-06-29 01:25:07 -04:00
committed by GitHub
parent 37c0198648
commit 186ffd4601

View File

@@ -225,7 +225,6 @@ A curated list of awesome C++ (or C) frameworks, libraries, resources, and shiny
* [LAMMPS](https://github.com/lammps/lammps) - A classical molecular dynamics code with a focus on materials modeling. It's an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. [GPL] [website](https://lammps.sandia.gov/)
* [MADNESS](https://github.com/m-a-d-n-e-s-s/madness) - Multiresolution Adaptive Numerical Environment for Scientific Simulation. [GPL] [website](https://github.com/m-a-d-n-e-s-s/madness)
* [MPQC](https://github.com/ValeevGroup/mpqc) - The Massively Parallel Quantum Chemistry program, MPQC, computes properties of atoms and molecules from first principles using the time independent Schrödinger equation. [GPL] [website](https://mpqc.org/)
* [ORCA](https://en.wikipedia.org/wiki/ORCA_(quantum_chemistry_program)) - An ab initio quantum chemistry program package that contains modern electronic structure methods. [Academic] [website](https://orcaforum.kofo.mpg.de/)
* [Psi](https://github.com/psi4/psi4) - An ab initio computational chemistry package. [GPL] [website](https://psicode.org/)
## CLI