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https://github.com/LCPQ/quantum_package
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removed debug
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@ -525,11 +525,6 @@ subroutine i_H_j_s2(key_i,key_j,Nint,hij,s2)
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ASSERT (sum(popcnt(key_j(:,1))) == elec_alpha_num)
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ASSERT (sum(popcnt(key_j(:,1))) == elec_alpha_num)
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ASSERT (sum(popcnt(key_j(:,2))) == elec_beta_num)
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ASSERT (sum(popcnt(key_j(:,2))) == elec_beta_num)
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if(sum(popcnt(key_i(:,1))) /= elec_alpha_num) stop "STOP2P 1"
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if(sum(popcnt(key_i(:,2))) /= elec_beta_num) stop "STOP2P 2"
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if(sum(popcnt(key_j(:,1))) /= elec_alpha_num) stop "ST2OPP 3"
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if(sum(popcnt(key_j(:,2))) /= elec_beta_num) stop "ST2OPP 4"
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hij = 0.d0
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hij = 0.d0
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s2 = 0d0
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s2 = 0d0
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!DIR$ FORCEINLINE
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!DIR$ FORCEINLINE
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@ -631,10 +626,6 @@ subroutine i_H_j(key_i,key_j,Nint,hij)
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ASSERT (sum(popcnt(key_i(:,2))) == elec_beta_num)
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ASSERT (sum(popcnt(key_i(:,2))) == elec_beta_num)
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ASSERT (sum(popcnt(key_j(:,1))) == elec_alpha_num)
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ASSERT (sum(popcnt(key_j(:,1))) == elec_alpha_num)
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ASSERT (sum(popcnt(key_j(:,2))) == elec_beta_num)
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ASSERT (sum(popcnt(key_j(:,2))) == elec_beta_num)
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if(sum(popcnt(key_i(:,1))) /= elec_alpha_num) stop "STOP2P 1"
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if(sum(popcnt(key_i(:,2))) /= elec_beta_num) stop "STOP2P 2"
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if(sum(popcnt(key_j(:,1))) /= elec_alpha_num) stop "ST2OPP 3"
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if(sum(popcnt(key_j(:,2))) /= elec_beta_num) stop "ST2OPP 4"
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hij = 0.d0
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hij = 0.d0
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