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7bb3a066b4
hf_again/out
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Anton Ljungdahl 7bb3a066b4 gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions
2024-11-02 19:47:23 +01:00
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bspline0.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bspline1.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bspline2.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bspline3.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bspline9.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bsplines_grid.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
bsplines_knots.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBspline0.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBspline1.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBspline2.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBspline3.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBspline9.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBsplines_grid.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
dBsplines_knots.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00
grid.bin bspline derivatives 2024-11-01 20:33:05 +01:00
grid.dat bspline derivatives 2024-11-01 20:33:05 +01:00
knotpoints.dat gets -0.5 hartree for hydrogen ground state! need refactor and then check other l and plot wavefunctions 2024-11-02 19:47:23 +01:00