update to fix 32-bit integers' issues on big endian architectures

nwchemgit / nwchem

NWChem: Open Source High-Performance Computational Chemistry

http://nwchemgit.github.io

Other

484 stars 161 forks source link

Closed edoapra closed 8 months ago

edoapra commented 8 months ago

ga_diag_seq(): make all integer arguments 32-bit in the call to dsygv
Parallel_Init(): [replaced TCGMSG and MPI calls with GA calls to avoid 32-bit integer issues