Job Name
Calculation	&generate_template_list("qchem", $username)
Interaction Approach	Counterpoise SAPT0 Other
Method	Hartree-Fock MP2 RIMP2 CCSD CCSD(T) PBE PBE0 B3LYP ωB97X ωB97X-D SAPT0 Other
Excited State Method	CIS SOSCIS(D) PBE PBE0 B3LYP ωB97X ωB97X-D Other
Basis Set	Minimal: STO-3G Basic: 3-21G Routine: 6-31G(d) Accurate: 6-311+G(d,p) cc-pVDZ cc-pVTZ cc-pVQZ aug-cc-pVDZ aug-cc-pVTZ aug-cc-pVQZ Other
Auxiliary Basis Set	None RIMP2-VDZ RIMP2-TZVPP RIMP2-cc-pVDZ RIMP2-cc-pVTZ RIMP2-cc-pVQZ RIMP2-aug-cc-pVDZ RIMP2-aug-cc-pVTZ RIMP2-aug-cc-pVQZ
Charge
Multiplicity	Singlet Doublet Triplet Quartet Quintet Sextet
Charge (Layer A)
Multiplicity (Layer A)	Singlet Doublet Triplet Quartet Quintet Sextet
Charge (Layer B)
Multiplicity (Layer B)	Singlet Doublet Triplet Quartet Quintet Sextet
Unrestricted

'' if ($version !~ /p|e$/)

Solvation Model	None ChemSol PCM
PCM dielectric
Freeze all core # frozen core # frozen virt.
Basis Set Type	Default Cartesian Spherical
AIMD number of steps
AIMD step size (au)
AIMD ensemble	Constant E / NVE Constant T / NVT
AIMD initial velocities	Thermal / Boltzmann
AIMD temperature (K)
Calculate Raman intensities
Calculate spin-spin coupling
Cartesian Coordinates
Use Restart File	None &generate_checkpoint_list($username, "qchem", $checkpointFile)
Save Restart File
Additional Keywords (comma delim.)

'' if ($version !~ /p|e$/)