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 BeH⁺ (beryllium monohydride cation)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		308
	Energy 298.15K		283
	Atomization Enthalpy 298.15K		0
	Atomization Enthalpy 0K		0
	Entropy (298.15K)	x	213	x
	Entropy at any temperature		213
	Integrated Heat Capacity		213
	Heat Capacity (Cp)		213
	Nuclear Repulsion Energy		296
	HOMO-LUMO Energies		286
	Barriers to Internal Rotation		0
Geometries	Cartesians		284
	Internal Coordinates		283
	Products of moments of inertia		279
	Rotational Constants		284
	Point Group		300
Vibrations	Vibrational Frequencies		285
	Vibrational Intensities		271
	Zero-point energies		285
	Vibrational scaling factors
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		167
	Dipole		179
	Quadrupole		174
	Polarizability		182
Other results	Spin		0
	Number of basis functions		51
	Conformations		1