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 ScH (Scandium monohydride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		439
	Energy 298.15K		429
	Atomization Enthalpy 298.15K		0
	Atomization Enthalpy 0K		0
	Entropy (298.15K)		0
	Entropy at any temperature		0
	Integrated Heat Capacity		0
	Heat Capacity (Cp)		0
	Nuclear Repulsion Energy		435
	HOMO-LUMO Energies		376
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	436
	Internal Coordinates	x	436	x
	Products of moments of inertia	x	432	x
	Rotational Constants	x	435	x
	Point Group		439
Vibrations	Vibrational Frequencies	fun.	435	x
	Vibrational Intensities		379
	Zero-point energies	x	435	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		5
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		255
	Dipole	x	338	x
	Quadrupole		281
	Polarizability		309
Other results	Spin		0
	Number of basis functions		46
	Conformations		1