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 BeOH (beryllium monohydroxide)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		1113
	Energy 298.15K		764
	Atomization Enthalpy 298.15K	x	33	x
	Atomization Enthalpy 0K	x	44	x
	Entropy (298.15K)	x	10	x
	Entropy at any temperature		10
	Integrated Heat Capacity	x	10	x
	Heat Capacity (Cp)	x	10	x
	Nuclear Repulsion Energy		1100
	HOMO-LUMO Energies		910
	Barriers to Internal Rotation		0
Geometries	Cartesians		1067
	Internal Coordinates		1067
	Products of moments of inertia		1065
	Rotational Constants		1080
	Point Group		1108
Vibrations	Vibrational Frequencies	fun.	1075	x
	Vibrational Intensities		1177
	Zero-point energies		1075
	Vibrational scaling factors
	Anharmonic frequencies and constants		1
	Raman frequencies and intensities		244
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		644
	Dipole		783
	Quadrupole		667
	Polarizability		681
Other results	Spin		1100
	Number of basis functions		31
	Conformations		2	x