Index
| A-tensor [1] | g-tensor [1] | selected atoms [1] |
| BLYP [1] | geometry optimization [1] | transition state search [1] |
| BP86 [1] | gradients [1] | unrestricted calculation [1] |
| constrained optimization [1] | LB94 [1] | XC [1] |
| ESR [1] | PBE [1] | ZORA [1] |
| exchange-correlation [1] | PW91 [1] | |
| frequencies [1] | RPBE [1] | |
