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fix bug

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This commit is contained in:
Pierre-Francois Loos 2021-02-13 22:49:15 +01:00
parent 692962fac2
commit 0271024041
1 changed files with 1 additions and 1 deletions
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src/eDFT/GOK_UKS.f90
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@ -210,7 +210,7 @@ subroutine GOK_UKS(x_rung,x_DFA,c_rung,c_DFA,nEns,wEns,nGrid,weight,aCC_w1,aCC_w
rhow(:,:) = rhow(:,:) + wEns(iEns)*rho(:,:,iEns)
end do
if(xc_rung > 1 .and. xc_rung /= 666) then
if(xc_rung > 1) then
! Ground state density