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computing SOC matrices with k-points with symmetry (fix) (cp2k#3513)
Co-authored-by: JWilhelm <[email protected]>
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Original file line number | Diff line number | Diff line change |
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@@ -1,10 +1,10 @@ | ||
01_G0W0_periodic_H2O.inp 106 1e-03 9.861 | ||
02_G0W0_IH_SOC_LDOS.inp 106 1e-03 17.826 | ||
02_G0W0_IH_SOC_LDOS.inp 107 1e-03 11.344 | ||
03_G0W0_bandstructure_IH_chain.inp 106 1e-03 21.977 | ||
03_G0W0_bandstructure_IH_chain.inp 108 2e-03 21.692 | ||
03_G0W0_bandstructure_IH_chain.inp 106 5e-04 21.977 | ||
03_G0W0_bandstructure_IH_chain.inp 108 5e-04 21.692 | ||
04_G0W0_SOC_TeH_chain_open_shell_kp_extrapol.inp 106 1e-03 5.174 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 106 1e-03 5.178 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 107 1e-03 0.306 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 108 1e-03 5.134 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 106 5e-04 5.178 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 107 5e-04 0.306 | ||
05_G0W0_SOC_TeH_chain_open_shell.inp 108 5e-04 5.134 | ||
#EOF |