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removed unnec print

This commit is contained in:
Loris Burth 2025-03-26 19:33:09 +01:00
parent 6d878d7a65
commit e2ad7d7bd2

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@ -134,7 +134,6 @@ subroutine cRHF(dotest,maxSCF,thresh,max_diis,guess_type,level_shift,ENuc, &
! CAP energy
EW = complex_trace_matrix(nBas,matmul(P,(0d0,1d0)*CAP))
write(*,*) "EW", EW
! Hartree energy