| Name | Last modified | Size | Description | |
|---|---|---|---|---|
| Parent Directory | - | |||
| 1-h2o-opt.inp | 2025-11-06 22:07 | 724 | ||
| 1-h2o-opt.out | 2005-01-07 23:54 | 700K | ||
| 1-h2o-opt.xyz | 2005-01-07 23:54 | 20K | ||
| 2-h2o-vib.inp | 2025-11-06 22:07 | 703 | ||
| 2-h2o-vib.out | 2005-01-07 14:22 | 64K | ||
| 3-h2o-pert.inp | 2025-11-06 22:07 | 711 | ||
| 3-h2o-pert.out | 2005-01-07 15:01 | 37K | ||
| DIPOLE-bomd | 2005-01-13 18:00 | 736K | ||
| DIPOLE-cp-200au | 2005-01-13 18:03 | 7.5M | ||
| DIPOLE-cp-400au | 2005-01-13 18:10 | 3.5M | ||
| ENERGIES-bomd | 2005-01-13 18:00 | 698K | ||
| ENERGIES-cp-200au | 2005-01-13 18:04 | 7.1M | ||
| ENERGIES-cp-400au | 2005-01-13 18:10 | 3.3M | ||
| H_CVB_BLYP.psp | 2025-11-06 22:07 | 1.0K | ||
| O_MT_BLYP.psp | 2025-11-06 22:07 | 83K | ||
| TRAJEC-bomd.xyz | 2005-01-13 18:01 | 51K | ||
| TRAJEC-cp-200.xyz | 2005-01-13 18:03 | 107K | ||
| TRAJEC-cp-400au.xyz | 2005-01-13 18:10 | 98K | ||
| VIB1.log | 2005-01-07 14:22 | 2.8K | ||
| bomd/ | 2005-01-13 17:58 | - | ||
| cp-200au/ | 2005-01-13 18:02 | - | ||
| cp-400au/ | 2005-01-13 18:10 | - | ||
| h2o-bomd.spec | 2005-01-13 18:05 | 22K | ||
| h2o-cp-200au.spec | 2005-01-13 18:07 | 46K | ||
| h2o-cp-400au.spec | 2005-01-13 18:11 | 43K | ||
| h2o-vib.spec | 2005-01-11 11:25 | 141 | ||
| mkspec.sh | 2005-01-05 18:52 | 106 | ||