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I.B.3. (II.A.2.)

All data (experiment and calculated) in the CCCBDB for GeO2 (Germanium dioxide)

INChI
InChI=1S/GeO2/c2-1-3

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 x    
Enthalpy 0K enthalpy of formation x    
Energy 0K   217  
Energy 298.15K   7  
Atomization Enthalpy 298.15K  0 
Atomization Enthalpy 0K  0 
Entropy (298.15K) entropy x0x
Entropy at any temperature   0  
Integrated Heat Capacity integrated heat capacity x0x
Heat Capacity (Cp) Heat capacity x0x
Nuclear Repulsion Energy   213  
HOMO-LUMO Energies HOMO energies   213  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians  213  
Internal Coordinates bond lengths bond angles  213 
Products of moments of inertia moments of inertia  208 
Rotational Constants rotational constants  213 
Point Group  214 
Vibrations Vibrational Frequencies vibrations x213x
Vibrational Intensities  196 
Zero-point energies x213x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   119  
Dipole dipole  119 
Quadrupole quadrupole  118 
Polarizability polarizability  119 
Other results Spin   0  
Number of basis functions   24  
Diagnostics   0  
Conformations   1