oxygen O2

XYZ [1KB]


Orbital data (ISO value 0.1)

Orbital 1
PGV [112KB]
WRL [138KB]

Orbital 2
PGV [112KB]
WRL [139KB]

Orbital 3
PGV [554KB]
WRL [694KB]

Orbital 4
PGV [719KB]
WRL [895KB]

Orbital 5
PGV [717KB]
WRL [893KB]

Orbital 6
PGV [675KB]
WRL [842KB]

Orbital 7
PGV [736KB]
WRL [917KB]

Orbital 8 (HOMO)
PGV [733KB]
WRL [912KB]

Orbital 9 (LUMO)
PGV [774KB]
WRL [965KB]

Orbital 10
PGV [776KB]
WRL [967KB]


PGV Samples / Copyright(C) 1996-1997 CCIMS / mizutani@ims.ac.jp