https://github.com/peppone98/quantum_md_h2
Computational Physics exam @ Unitn. The repository contains a C++ code for the quantum molecular dynamics of the hydrogen molecule. The code can be found in the folder CODE, while a discussion of the outputs and the algorithms employed can be found in the REPORT folder.
https://github.com/peppone98/quantum_md_h2
ab-initio computational-physics conjugate-gradient density-functional-theory hartree-fock molecular-dynamics quantum-mechanics quantum-physics
Last synced: 7 months ago
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Computational Physics exam @ Unitn. The repository contains a C++ code for the quantum molecular dynamics of the hydrogen molecule. The code can be found in the folder CODE, while a discussion of the outputs and the algorithms employed can be found in the REPORT folder.
- Host: GitHub
- URL: https://github.com/peppone98/quantum_md_h2
- Owner: Peppone98
- Created: 2023-04-01T08:27:55.000Z (about 3 years ago)
- Default Branch: main
- Last Pushed: 2023-09-27T10:34:48.000Z (over 2 years ago)
- Last Synced: 2024-12-28T13:47:54.661Z (over 1 year ago)
- Topics: ab-initio, computational-physics, conjugate-gradient, density-functional-theory, hartree-fock, molecular-dynamics, quantum-mechanics, quantum-physics
- Language: C++
- Homepage:
- Size: 17 MB
- Stars: 0
- Watchers: 1
- Forks: 0
- Open Issues: 0