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	hartrees
Energy at 0K	-8942.184892
Energy at 298.15K	-8942.178022
HF Energy	-8942.184892
Nuclear repulsion energy	1401.036434

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	346	343	0.00
2	E	203	202	0.00
2	E	203	202	0.00
3	T₂	258	257	0.34
3	T₂	258	257	0.34
3	T₂	258	257	0.34

Atom	x (Å)	y (Å)	z (Å)
As1	0.873	0.873	0.873
As2	-0.873	-0.873	0.873
As3	-0.873	0.873	-0.873
As4	0.873	-0.873	-0.873

	As1	As2	As3	As4
As1		2.4679	2.4679	2.4679
As2	2.4679		2.4679	2.4679
As3	2.4679	2.4679		2.4679
As4	2.4679	2.4679	2.4679

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
As1	As2	As3	60.000	As1	As2	As4	60.000
As1	As3	As2	60.000	As1	As3	As4	60.000
As1	As4	As2	60.000	As1	As4	As3	60.000
As2	As1	As3	60.000	As2	As1	As4	60.000
As2	As3	As4	60.000	As2	As4	As3	60.000
As3	As1	As4	60.000	As3	As2	As4	60.000

All results from a given calculation for As₄ (Arsenic tetramer)

using model chemistry: PBEPBE/aug-cc-pVDZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken	CHELPG	AIM	ESP
1	As	0.000
2	As	0.000
3	As	0.000
4	As	0.000

	x	y	z	Total
	0.000	0.000	0.000	0.000
CHELPG
AIM
ESP

	x	y	z
x	17.683	0.000	0.000
y	0.000	17.683	0.000
z	0.000	0.000	17.683

<r²>	345.142
(<r²>)^1/2	18.578

All results from a given calculation for As4 (Arsenic tetramer)

using model chemistry: PBEPBE/aug-cc-pVDZ

States and conformations

All results from a given calculation for As₄ (Arsenic tetramer)