srDFT_SC/new/H10_vqz/data/data_DFT_vqzE_error
2019-10-17 18:30:43 +02:00

9 lines
460 B
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1.4 0.00622 0.002210305 -0.0003732498 -0.0003732498
1.6 0.005 0.0016625401 -0.000804580600001 -0.000804580600001
1.8 0.00472 0.0018726053 -0.0005064687 -0.0005064687
2.0 0.00455 0.00206141 -0.0002517395 -0.0002517395
2.4 0.00444 0.0024712991 0.0002878905 0.0002878905
2.8 0.00431 0.0027666635 0.0007719462 0.0007719462
3.2 0.00414 0.0029675439 0.0012223006 0.0012223006
3.6 0.0038 0.0029453938 0.0014888397 0.0014888397