Fix bug in casscf
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c0e76b8f26
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@ -58,8 +58,10 @@ subroutine run
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! if(n_states == 1)then
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! call ezfio_get_casscf_cipsi_energy_pt2(E_PT2)
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! call ezfio_get_casscf_cipsi_energy(PT2)
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call write_double(6,E_PT2(1:N_states),'E + PT2 energy = ')
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call write_double(6,PT2(1:N_states),' PT2 = ')
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do istate=1,N_states
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call write_double(6,E_PT2(istate),'E + PT2 energy = ')
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call write_double(6,PT2(istate),' PT2 = ')
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enddo
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call write_double(6,pt2_max,' PT2_MAX = ')
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! endif
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