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Merge pull request #125 from pihanqi/master
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fix output bugs in sigma_OHE
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quanshengwu authored Aug 29, 2023
2 parents a5bb81a + c3b7d42 commit 1cd2d09
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion src/sigma_OHE.f90
Original file line number Diff line number Diff line change
Expand Up @@ -660,7 +660,7 @@ subroutine sigma_ohe_calc_symm(mu_array, KBT_array, BTau_array, Nband_Fermi_Leve
if (abs(det3(rho))>eps6) then
call inv_r(3, rho)
write(rhofileindex(ie), '(19E16.6)')&
BTau_array(i)*Magneticfluxdensity_atomic/Relaxation_Time_Tau*0.175874356d0, &
BTau_array(i)*Magneticfluxdensity_atomic/Relaxation_Time_Tau, &
rho(1, 1:3), rho(2, 1:3), rho(3, 1:3)
else
write(rhofileindex(ie), '(a)')'# error: sigma is zero since no k points contribute to the calculations of MR'
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