SeMe2(SiH3)4 Wiberg

DOI: 10.14469/hpc/3227 Metadata

Created: 2017-11-07 13:58

Last modified: 2019-02-05 16:48

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Gaussian Calculation

Files

FilenameSizeTypeDescription
input.gjf 1KB chemical/x-gaussian-input Gaussian input file
gaussian.log 1MB chemical/x-gaussian-log Gaussian log file
checkpoint.fchk 4MB chemical/x-gaussian-checkpoint Formatted checkpoint file
cml.xml 3KB application/xml Optimised geometry
wavefunction.wfn 0 chemical/x-gaussian-wavefunction 'Wavefunction'

Member of collection / collaboration

DOIDescription
10.14469/hpc/333 blog

Subject Keywords

KeywordValue
inchi InChI=1S/C2H6Se.4H3Si/c1-3-2;;;;/h1-2H3;4*1H3
inchi InChI=1S/C2H18SeSi4/c1-3(2,4,5,6)7/h1-2,4-7H3
inchi InChI=1S/C2H6Se.4H3Si/c1-3-2;;;;/h1-2H3;4*1H3
inchikey POCYZWVEMDWNEN-UHFFFAOYSA-N
inchikey NLLRQLFHDVFXDI-UHFFFAOYSA-N
inchikey POCYZWVEMDWNEN-UHFFFAOYSA-N

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