QUESTDB_website/static/data/structures/QUEST2/carbon_trimer.xyz

mirror of https://github.com/LCPQ/QUESTDB_website.git synced 2024-12-26 06:14:38 +01:00
3
^1\Sigma_g^+,CC3,aug-cc-pVTZ
C    0.00000000    0.00000000    0.00000000
C    0.00000000    0.00000000    1.29831307
C    0.00000000    0.00000000   -1.29831307
Add geometries for QUEST#2 (without comments) 2020-08-28 14:09:43 +02:00			`3`
Add metadatas for QUEST#2 geometries 2020-08-28 15:04:40 +02:00			`^1\Sigma_g^+,CC3,aug-cc-pVTZ`
Add geometries for QUEST#2 (without comments) 2020-08-28 14:09:43 +02:00			`C 0.00000000 0.00000000 0.00000000`
			`C 0.00000000 0.00000000 1.29831307`
			`C 0.00000000 0.00000000 -1.29831307`