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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	C*V	³Σ
4	1	yes	C*V	¹Σ

	hartrees
Energy at 0K	-2255.554018
Energy at 298.15K	-2255.554481
HF Energy	-2255.554018
Nuclear repulsion energy	109.672953

Atom	x (Å)	y (Å)	z (Å)
Ga1	0.000	0.000	0.732
P2	0.000	0.000	-1.512

	Ga1	P2
Ga1		2.2436
P2	2.2436

Number	Element	Mulliken	CHELPG	AIM	ESP
1	Ga	0.140
2	P	-0.140

All results from a given calculation for GaP (Gallium monophosphide)

using model chemistry: B1B95/3-21G*

States and conformations

State 1 (³Σ)

State 2 (³Π)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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<r²>	69.702
(<r²>)^1/2	8.349

All results from a given calculation for GaP (Gallium monophosphide)

using model chemistry: B1B95/3-21G*

States and conformations

State 1 (3Σ)

State 2 (3Π)

State 1 (³Σ)

State 2 (³Π)