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 ZnO (zinc monoxide)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		218
	Energy 298.15K		206
	Atomization Enthalpy 298.15K		141
	Atomization Enthalpy 0K		141
	Entropy (298.15K)		140
	Entropy at any temperature		140
	Integrated Heat Capacity		140
	Heat Capacity (Cp)		140
	Nuclear Repulsion Energy		211
	HOMO-LUMO Energies		213
	Barriers to Internal Rotation		0
Geometries	Cartesians		213
	Internal Coordinates		212
	Products of moments of inertia		208
	Rotational Constants		210
	Point Group		215
Vibrations	Vibrational Frequencies	fun.	210	x
	Vibrational Intensities		208
	Zero-point energies	x	210	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		134
	Dipole		143
	Quadrupole		136
	Polarizability		140
Other results	Spin		0
	Number of basis functions		4
	Conformations		1