#82 Update genciwfn.cpp

[pm-235779]

Issue Details

File: genciwfn.cpp - Line: 46
Incorrect Variable: nword2
Correct Variable: nword
Code Before Correction
k += wfn.nword2;

Code After Correction
k += wfn.nword;

[msricher]

Hi, I'll address this after @q-pratz-chem uploads her PR which uses GenCIWfn extensively. She has probably fixed this in the meantime.

[pm-235779]

Hi, I'll address this after @q-pratz-chem uploads her PR which uses GenCIWfn extensively. She has probably fixed this in the meantime.

ok ill wait till then

[q-pratz-chem]

Hi, I'll address this after @q-pratz-chem uploads her PR which uses GenCIWfn extensively. She has probably fixed this in the meantime.

ok ill wait till then

Hi, I fixed it to use the GenCIWfn as a base class for the NonSingletCI class. I will make a PR collectively for the NonSingletCI and geminal wavefunction implementation, which includes a fix for this issue as well.

[pm-235779]

Hi @msricher ,

Since you mentioned that @q-pratz-chem PR should be merged first, could you please let me know if I should proceed with any changes on my end, or wait until her PR is merged? Happy to coordinate accordingly.

Best regards,
@pm-235779