|
|
64e28327a1
|
some refactor towards fat struct
|
2026-03-29 21:52:29 +02:00 |
|
|
|
8c3f3a2947
|
atom with eigensolution and arenas
|
2026-03-24 21:07:42 +01:00 |
|
|
|
261a1030ea
|
arenas for matrices and some cleanup
|
2026-03-24 16:37:04 +01:00 |
|
|
|
8b1dedbed6
|
refactor out sort functions
|
2026-03-24 12:13:05 +01:00 |
|
|
|
d670d018b7
|
working version with treesitter
|
2026-03-24 11:56:29 +01:00 |
|
|
|
0e7c8c2ac8
|
some version trying clangd but it works poorly with single translation unit build
|
2026-03-24 10:01:01 +01:00 |
|
Anton Ljungdahl
|
fc2c897727
|
ok norm maybe
|
2024-11-18 17:42:31 +01:00 |
|
Anton Ljungdahl
|
519a5c1dd0
|
more eigenvectors and some refactoring
|
2024-11-12 12:56:55 +01:00 |
|
Anton Ljungdahl
|
1ae83767ff
|
eigenvectors, some fixing
|
2024-11-05 22:23:16 +01:00 |
|
Anton Ljungdahl
|
ae39bb793f
|
some refactoring and quicksort
|
2024-11-04 23:41:32 +01:00 |
|
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 |
|
Anton Ljungdahl
|
b950d90719
|
bspline derivatives
|
2024-11-01 20:33:05 +01:00 |
|
Anton Ljungdahl
|
9e3c1a11b1
|
gauss legendre integration
|
2024-10-30 19:29:04 +01:00 |
|
Anton Ljungdahl
|
afa1a2be27
|
first commit after copy from eigsol_gpu
|
2024-10-29 22:33:35 +01:00 |
|
|
|
58fb3925bc
|
Initial commit
|
2024-10-29 21:03:57 +00:00 |
|
