GENERAL INFO

Title: /Gaussian_data_GGA WO4
Browse item: https://iochem-bd.iciq.es:443/browse/handle/100/68851
Program: Gaussian 16 AM64L-G16RevA.03
Author: Benzidi, Hind
Formula: O4W
Calculation type: Geometry optimization Minimum
Method(s): RwB97XD - Grimme-D2

ATOM INFO

Atomic coordinates [Å] (optimized)

MOLECULAR INFO

Charge / Multiplicity: -2 1

Full point group
Full point group CS NOp 2

JOB |

Energies

Energy Value Units
SCF Done: -368.784147038 Eh

Mulliken charges

Dipole moment (Debye)

Dipole moment

X Y Z Total
0.0004 0.0014 -0.0000 0.0015

Quadrupole moment

XX YY ZZ XY XZ YZ
-64.2916 -64.2931 -64.3053 0.0041 -0.0000 0.0000

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