diphenylether C12H10O
XYZ [1KB]
Orbital data (ISO value 0.05)
Orbital 45 (HOMO)
PGV [1068KB]
WRL [1351KB]
Orbital 45 (LUMO)
PGV [1063KB]
WRL [1344KB]
Gaussian outputs
- optimize [744KB]
- frequency [152KB]
- orbitals [40KB]
PGV Samples /
Copyright(C) 1996-1997 CCIMS /
mizutani@ims.ac.jp