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| | MOLSCAT, Version 14, User's manual, Section 3 |
 | | The parameters input in &BASIS specify the collision type, the quantum numbers and energies of the levels to be used in the basis set, and the dynamical approximations (if any) to be used in constructing the coupled equations. |
 | | ELEVEL is an array of NLEVEL molecular level energies, corresponding to the levels in the JLEVEL array. |
 | | Each level is described on IASYMU by J,ITAU,ELVL (2I5,F15.10) where J is the rotational quantum number, ITAU is an index that is not actually used, and ELVL is the rotor energy (in 1/cm unless &BASIS EUNITS has specified otherwise). |
| theochem.uwaterloo.ca /molscat/Section3.html (3471 words) |
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