return to home page Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All data (experiment and calculated) in the CCCBDB for GeO (Germanium monoxide)

1907021335
Other names
germanium(II) oxide;
INChI
InChI=1S/GeO/c1-2

An "x" indicates that data is available. A number indicates how many calculations have been completed.
Property Experiment Calculated Comparison
Energies
Entropies
Enthalpy 298.15K enthalpy of formation      
Enthalpy 0K enthalpy of formation      
Energy 0K   732  
Energy 298.15K   156  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
Entropy (298.15K) entropy  0 
Entropy at any temperature   0  
Integrated Heat Capacity integrated heat capacity  0 
Heat Capacity (Cp) Heat capacity  0 
Nuclear Repulsion Energy   730  
HOMO-LUMO Energies HOMO energies   659  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x730  
Internal Coordinates bond lengths bond angles x730x
Products of moments of inertia moments of inertia x722x
Rotational Constants rotational constants x730x
Point Group  731 
Vibrations Vibrational Frequencies vibrations fun. har.730x
Vibrational Intensities  1027 
Zero-point energies x730x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Raman frequencies and intensities   474  
Electronic States Electronic states x 0  
Electrostatics Atom charges   411  
Dipole dipole x577x
Quadrupole quadrupole  474 
Polarizability polarizability  483 
Other results Spin   0  
Number of basis functions   64  
Conformations   1