Gaussian Job Archive for C2H6

Name: Gaussian Job Archive for C2H6
Published: 2014-04-10T13:41:45+00:00
License: https://creativecommons.org/licenses/by/4.0/
Keywords: InChI=1S/C2H6/c1-2/h1-2H3, Pop=(Minimal), Freq, RHF/STO-3G, GenChk, SCRF=Check, Guess=TCheck, Geom=AllCheck, #N, C2H6, cc, InChIKey=OTMSDBZUPAUEDD-UHFFFAOYSA-N, opt, Organic Chemistry

dataset

posted on 2014-04-10, 13:41 authored by M J HarveyM J Harvey

Archive of work produced using the resources of the Imperial College High Performance Computing Service.

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Keywords

InChI=1S/C2H6/c1-2/h1-2H3 Pop=(Minimal)Freq RHF/STO-3G GenChk SCRF=Check Guess=TCheck Geom=AllCheck #N C2H6 cc InChIKey=OTMSDBZUPAUEDD-UHFFFAOYSA-N opt Organic Chemistry

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CC BY 4.0

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