TMS-OXB3LYP30

DOI: 10.14469/hpc/15616 Metadata

Created: 2025-12-18 11:54

Last modified: 2025-12-18 16:11

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Gaussian 16 calculation

Files

FilenameSizeTypeDescription
TMS-OXB3LYP30.log 236KB chemical/x-gaussian-log Gaussian log file

Member of collection / collaboration

DOIDescription
10.14469/hpc/15614 Molecules of the year 2025: Cyclo[48]carbon - bond alternation and Raman Activity Spectrum.

Subject Keywords

KeywordValue
inchi InChI=1S/C4H12Si/c1-5(2,3)4/h1-4H3
inchikey CZDYPVPMEAXLPK-UHFFFAOYSA-N

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