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Hopefully got compute_born_matrix numdiff method working. Also added two BORN_MATRIX examples.

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Germain Clavier
2022-02-08 16:40:52 +01:00
parent ba89ad546a
commit 9833e5bc66
19 changed files with 200696 additions and 38 deletions
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examples/BORN_MATRIX/Numdiff/stre_matrix.out Normal file
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# Cij Matrix from post process computation
1.10120 0.69454 0.66285 0.01885 0.01902 -0.01367
0.69454 1.20617 0.65567 0.00893 0.00839 -0.00873
0.66285 0.65567 1.11090 -0.01593 0.01634 -0.00483
0.01885 0.00893 -0.01593 0.42772 0.01316 0.01666
0.01902 0.00839 0.01634 0.01316 0.52416 -0.01733
-0.01367 -0.00873 -0.00483 0.01666 -0.01733 0.49891