Match Born charge diff w=0.1
Commits >
Commit 70b0ad3565a7ed52254e6fb5a8a40b027abeb4a7 >
Run foss_cmake: [foss2022a-serial, foss-full] >
Input 04-silicon.03-emresp.inp
Value | Reference | Precision | Status |
-2.954800000000000e+00 | -2.954800000000000e+00 | 1.480000000000000e-05 | PASS |
Command: GREPFIELD(em_resp/freq_0.1000/born_charges, "Discrepancy", 3, 5)