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 LiCl (lithium chloride)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K	x
	Enthalpy 0K	x
	Energy 0K		823
	Energy 298.15K		520
	Atomization Enthalpy 298.15K	x	14	x
	Atomization Enthalpy 0K	x	15	x
	Entropy (298.15K)	x	5	x
	Entropy at any temperature		5
	Integrated Heat Capacity	x	5	x
	Heat Capacity (Cp)	x	5	x
	Nuclear Repulsion Energy		807
	HOMO-LUMO Energies		678
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	795
	Internal Coordinates	x	795	x
	Products of moments of inertia	x	787	x
	Rotational Constants	x	797	x
	Point Group		809
Vibrations	Vibrational Frequencies	fun. har.	795	x
	Vibrational Intensities		877
	Zero-point energies	x	795	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
	Raman frequencies and intensities		157
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		426
	Dipole	x	569	x
	Quadrupole		463
	Polarizability		505
Other results	Spin		8
	Number of basis functions		100
	Conformations		1