I have configured my psi4 built with ~/cmake3/bin/cmake -DCMAKE_INSTALL_PREFIX=$HOME/psi4gpu -DENABLE_ecpint=ON -DENABLE_gauxc=ON -Dgauxc_ENABLE_GPU=ON -DCMAKE_PREFIX_PATH=/usr/local/magma -Dgauxc_ENABLE_MAGMA=ON -DCMAKE_CUDA_ARCHITECTURES=121 ..
using the latest source code github Psi4 1.11a1.dev13
Git: Rev {master} eff3304 dirty
compilations runs through without problems.
yet when I want to use
SCFTYPE J_ALGO+SNLINK
the program crashes with
! !
! Fatal Error: J_ALGO+SNLINK is not a valid choice !
! Error occurred in file: !
!
/psi4/src/psi4/liboptions/liboptions.h on line: 50 !