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

All data (experiment and calculated) in the CCCBDB for GaO (Gallium monoxide)


An "x" indicates that data is available. A number indicates how many calculations have been completed.
Property Experiment Calculated Comparison
Enthalpy 298.15K enthalpy of formation      
Enthalpy 0K enthalpy of formation      
Energy 0K   310  
Energy 298.15K   8  
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   309  
HOMO-LUMO Energies HOMO energies   304  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x304  
Internal Coordinates bond lengths bond angles x304x
Products of moments of inertia moments of inertia  296 
Rotational Constants rotational constants  302 
Point Group  310 
Vibrations Vibrational Frequencies vibrations x302x
Vibrational Intensities  255 
Zero-point energies x302x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   182  
Dipole dipole  234 
Quadrupole quadrupole  220 
Polarizability polarizability  168 
Other results Spin   309  
Number of basis functions   27  
Diagnostics   0  
Conformations   1