Index of /mgcf/tutorials_sample_files/Orca/UMA_ORCA

[ICO]NameLast modifiedSizeDescription
[PARENTDIR]Parent Directory  -  
[ ]4_start.xyz2026-09-21 23:04 3.3K 
[ ]5_start.xyz2026-09-21 23:04 3.3K 
[ ]freq_init.inp2026-09-21 22:59 322  
[ ]freq_init.out2026-09-21 22:59 924K 
[ ]geom_16.xyz2026-09-21 22:59 5.9K 
[ ]neb-idpp.inp2026-09-21 22:59 253  
[ ]neb-idpp.out2026-09-21 22:59 29K 
[ ]neb-idpp_initial_path_trj.xyz2026-09-21 22:59 120K 
[ ]neb_4_5.inp2026-09-21 22:59 391  
[ ]neb_4_5.out2026-09-21 22:59 54K 
[ ]neb_4_5_MEP_trj.xyz2026-09-21 22:59 67K 
[ ]opt_4.inp2026-09-21 22:59 282  
[ ]opt_4.out2026-09-21 22:59 3.2M 
[ ]opt_4.xyz2026-09-21 22:59 5.9K 
[ ]opt_5.inp2026-09-21 22:59 282  
[ ]opt_5.out2026-09-21 22:59 2.4M 
[ ]opt_5.xyz2026-09-21 22:59 5.9K 
[ ]optts.inp2026-09-21 22:59 504  
[ ]optts.out2026-09-21 22:59 2.6M 
[ ]optts.xyz2026-09-21 22:59 5.9K 
[ ]struct_traj.xyz2026-09-21 22:59 189K 
[ ]xtb_inp_12026-09-21 22:59 22  
[ ]xtb_inp_22026-09-21 22:59 35