Memory set to 46.566 GiB by Python driver. Traceback (most recent call last): File "/nlsasfs/home/quantchem/vraghav/Setup/Conda/Conda/envs/psi4/bin/psi4", line 372, in exec(content) File "", line 62, in RuntimeError: Fatal Error: FALSE is not a valid choice Error occurred in file: /home/conda/feedstock_root/build_artifacts/psi4_1691021540832/work/psi4/src/psi4/liboptions/liboptions.h on line: 50 The most recent 5 function calls were: psi::PsiException::PsiException(std::__cxx11::basic_string, std::allocator >, char const*, int) Printing out the relevant lines from the Psithon --> Python processed input file: 7 -2.737089000 -1.745529000 -0.960960000 6 -3.349190000 -0.139882000 1.950364000 8 -4.312343000 0.473599000 1.724216000 8 -2.389423000 -0.750236000 2.189553000 """) --> core.set_local_option("SCF", "SCF_INITIAL_ACCELERATOR", "false") core.set_local_option("SCF", "GUESS_PERSIST", "true") psi4.optimize('m062x/6-31G**', molecule=SixM_SN_3, maxiter=500) scf_e, scf_wfn = psi4.frequency('m062x/6-31G**', molecule=SixM_SN_3, return_wfn=True) fchk_writer = psi4.core.FCHKWriter(scf_wfn) fchk_writer.write('SixM_SN_3.fchk') !----------------------------------------------------------------------------------! ! ! ! Fatal Error: FALSE is not a valid choice ! ! Error occurred in file: /home/conda/feedstock_root/build_artifacts/psi4_16910215 ! ! 40832/work/psi4/src/psi4/liboptions/liboptions.h on line: 50 ! ! The most recent 5 function calls were: ! ! psi::PsiException::PsiException(std::__cxx11::basic_string, std::allocator >, char const*, int) ! ! ! !----------------------------------------------------------------------------------! Psi4 stopped on: Friday, 25 August 2023 12:25AM Psi4 wall time for execution: 0:00:01.89 *** Psi4 encountered an error. Buy a developer more coffee! *** Resources and help at github.com/psi4/psi4.