Open susilehtola opened 1 year ago
Perhaps the SONAME of qcint can be changed so that pyscf built against libcint cannot dynamically load qcint?
Perhaps the SONAME of qcint can be changed so that pyscf built against libcint cannot dynamically load qcint?
Yes, definitely! This would be the correct solution.
I have an idea related to this @sunqm
What do you think about cmakedefining SIMDD at build time? After all, the simd width is set when the library is built and should not be changed afterwards.
This would help to ensure that the correctness of an application linking qcint does not depend on the compile flags used to build it.
See https://github.com/pyscf/pyscf/issues/1855