Welcome to the PSI4 Forum!
Reduce size of Docker image
Frozen core for cations
Psi4 in parallel: PSIO_ERROR
Calculating atomization energies
The pseudopotential problem of heavy elements
Is CCSD threading broken in 1.1?
Is there parallelization for ccsd calculation in Psi4?
Transition state search
Initial guess for CC3 calculations
F-SAPT post-processing issue
Problems to read ECP
TDDFT calculations in PSI4
How to get .molden or .fchk from PSIMRCC?
PCM Solver Geometry Optimization
Molecule in uniform electric field
Basis set for Ag
The sample 'scf-response1' gives errors
Choose Multipole Expansion Center
Electric field perturbation doesn't work on ccsd energy calculation
Use fractional charge in calculation
Time performance of SAPT with external point charges
Continuing after failed geometry optimization
Issue with integrals
SAPT0 stops without error message
EOM-CC3 strange default logic?
SCF problems! Please Help!
OEPROP after dropping electron from HOMO
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