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	hartrees
Energy at 0K	-677.859068
Energy at 298.15K	-677.859989
HF Energy	-677.859068
Nuclear repulsion energy	10.300249

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	1348	1224	0.00
2	Σ_u	1281	1164	922.98
3	Π_u	211	191	924.33
3	Π_u	211	191	924.33

Atom	x (Å)	y (Å)	z (Å)
Ca1	0.000	0.000	0.000
H2	0.000	0.000	2.081
H3	0.000	0.000	-2.081

	Ca1	H2	H3
Ca1		2.0807	2.0807
H2	2.0807		4.1614
H3	2.0807	4.1614

Number	Element	Mulliken
1	Ca	0.944
2	H	-0.472
3	H	-0.472

All results from a given calculation for CaH₂ (Calcium Hydride)

using model chemistry: HF/6-311G**

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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<r²>	24.844
(<r²>)^1/2	4.984

All results from a given calculation for CaH2 (Calcium Hydride)

using model chemistry: HF/6-311G**

States and conformations

All results from a given calculation for CaH₂ (Calcium Hydride)