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

All data (experiment and calculated) in the CCCBDB for He2+ (helium dimer cation)

INChI
InChI=1S/He2/c1-2/q+1

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   243  
Energy 298.15K   7  
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   237  
HOMO-LUMO Energies HOMO energies   237  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x221  
Internal Coordinates bond lengths bond angles x221x
Products of moments of inertia moments of inertia x233x
Rotational Constants rotational constants x237x
Point Group  238 
Vibrations Vibrational Frequencies vibrations x238x
Vibrational Intensities  211 
Zero-point energies x238x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states   0  
Electrostatics Atom charges   134  
Dipole dipole  139 
Quadrupole quadrupole  139 
Polarizability polarizability  125 
Other results Spin   225  
Number of basis functions   22  
Diagnostics   0  
Conformations   1