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

All data (experiment and calculated) in the CCCBDB for NaK (Sodium Potassium)

INChI
InChI=1S/K.Na

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   203  
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   202  
HOMO-LUMO Energies HOMO energies   202  
Barriers to Internal Rotation internal rotation  0 
Geometries Cartesians x202  
Internal Coordinates bond lengths bond angles x202x
Products of moments of inertia moments of inertia x196x
Rotational Constants rotational constants x202x
Point Group  203 
Vibrations Vibrational Frequencies vibrations x201x
Vibrational Intensities  195 
Zero-point energies x201x
Vibrational scaling factors x
Anharmonic frequencies and constants      
Electronic States Electronic states x 0  
Electrostatics Atom charges   126  
Dipole dipole x128x
Quadrupole quadrupole  126 
Polarizability polarizability  126 
Other results Spin   0  
Number of basis functions   21  
Diagnostics   0  
Conformations   1