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	hartrees
Energy at 0K	-2227.512761
Energy at 298.15K
HF Energy	-2227.512761
Nuclear repulsion energy	176.620587

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	Σ_g	890	890	0.00	50.47	0.11	0.20
2	Σ_u	1062	1062	83.83	0.00	0.00	0.00
3	Π_u	206	206	41.87	0.00	0.00	0.00
3	Π_u	206	206	41.87	0.00	0.00	0.00

Atom	x (Å)	y (Å)	z (Å)
Ge1	0.000	0.000	0.000
O2	0.000	0.000	1.630
O3	0.000	0.000	-1.630

	Ge1	O2	O3
Ge1		1.6299	1.6299
O2	1.6299		3.2598
O3	1.6299	3.2598

Number	Element	Mulliken
1	Ge	1.298
2	O	-0.649
3	O	-0.649

All results from a given calculation for GeO₂ (Germanium dioxide)

using model chemistry: mPW1PW91/daug-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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<r²>	60.585
(<r²>)^1/2	7.784

All results from a given calculation for GeO2 (Germanium dioxide)

using model chemistry: mPW1PW91/daug-cc-pVDZ

States and conformations

All results from a given calculation for GeO₂ (Germanium dioxide)