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Repositories (4)
HartreeFock
aromanro/HartreeFock
C++
A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaussian orbitals
67
19
SolarSystem
aromanro/SolarSystem
C++
A solar system simulator with Verlet, using OpenGL for displaying.
67
19
DFTAtom
aromanro/DFTAtom
C++
Density Functional Theory in real space, for atoms, LDA and LSDA
31
6
EmpiricalPseudopotential
aromanro/EmpiricalPseudopotential
C++
Band structure computation using empirical pseudopotentials
3
5