ammonia NH3
XYZ [1KB]
Orbital data (ISO value 0.05)
Orbital 5 (HOMO)
PGV [825KB]
WRL [1031KB]
Orbital 6 (LUMO)
PGV [2030KB]
WRL [2565KB]
Gaussian outputs
- optimize [44KB]
- frequency [24KB]
- orbitals [11KB]
PGV Samples /
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