By solving issue #1043, I have encountered that updating our conda libint dependency from 2.6.0 to 2.7.2 breaks our LibintInterfacer by causing an error of the form:
//gqcp/src/Basis/Integrals/Interfaces/LibintInterfacer.cpp:192: error: 'std::vector<libint2::Shell>' is not an accessible base of 'libint2::BasisSet'
I postponed the libint update in PR #1044, but we should definitely refactor our LibintInterface to be consistent with the latest libint version.
By solving issue #1043, I have encountered that updating our conda
libintdependency from 2.6.0 to 2.7.2 breaks ourLibintInterfacerby causing an error of the form:I postponed the
libintupdate in PR #1044, but we should definitely refactor ourLibintInterfaceto be consistent with the latestlibintversion.