Index of /~legacy.akohlmey/cpmd-tutor/reference/10-h2o_single

[ICO]NameLast modifiedSizeDescription

[PARENTDIR]Parent Directory   -  
[TXT]1-h2o-opt.inp 2025-05-07 22:08 724  
[TXT]1-h2o-opt.out 2005-01-07 23:54 700K 
[   ]1-h2o-opt.xyz 2005-01-07 23:54 20K 
[TXT]2-h2o-vib.inp 2025-05-07 22:08 703  
[TXT]2-h2o-vib.out 2005-01-07 14:22 64K 
[TXT]3-h2o-pert.inp 2025-05-07 22:08 711  
[TXT]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 
[TXT]H_CVB_BLYP.psp 2025-05-07 22:08 1.0K 
[   ]O_MT_BLYP.psp 2025-05-07 22:08 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 
[TXT]VIB1.log 2005-01-07 14:22 2.8K 
[DIR]bomd/ 2005-01-13 17:58 -  
[DIR]cp-200au/ 2005-01-13 18:02 -  
[DIR]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