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added check_sym
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@ -57,7 +57,11 @@ subroutine run
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implicit none
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implicit none
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integer :: i
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integer :: i
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call H_apply_cis
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if(pseudo_sym)then
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call H_apply_cis_sym
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else
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call H_apply_cis
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endif
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print *, 'N_det = ', N_det
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print *, 'N_det = ', N_det
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print*,'******************************'
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print*,'******************************'
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print *, 'Energies of the states:'
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print *, 'Energies of the states:'
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@ -5,5 +5,10 @@ BEGIN_SHELL [ /usr/bin/env python2 ]
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from generate_h_apply import H_apply
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from generate_h_apply import H_apply
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H = H_apply("cis",do_double_exc=False)
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H = H_apply("cis",do_double_exc=False)
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print H
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print H
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H = H_apply("cis_sym",do_double_exc=False)
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H.filter_only_connected_to_hf()
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print H
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END_SHELL
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END_SHELL
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