I.B.3. (II.A.2.)

All data (experiment and calculated) in the CCCBDB for PH⁺ (phosphorus monohydride cation)

Property		Experiment	Calculated	Comparison
Energies Entropies	Enthalpy 298.15K
	Enthalpy 0K
	Energy 0K		236
	Energy 298.15K		10
	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		231
	HOMO-LUMO Energies		230
	Barriers to Internal Rotation		0
Geometries	Cartesians	x	230
	Internal Coordinates	x	230	x
	Products of moments of inertia	x	223	x
	Rotational Constants	x	230	x
	Point Group		232
Vibrations	Vibrational Frequencies	x	230	x
	Vibrational Intensities		215
	Zero-point energies	x	230	x
	Vibrational scaling factors	x
	Anharmonic frequencies and constants
Electronic States	Electronic states	x	0
Electrostatics	Atom charges		131
	Dipole		136
	Quadrupole		136
	Polarizability		136
Other results	Spin		229
	Number of basis functions		34
	Diagnostics		1
	Conformations		1