N2F2 (2+) NEDA = 2, 2,1 2, 2 2, -2 Total Interaction (E) : 92.876

DOI: 10.14469/hpc/15501 Metadata

Created: 2025-08-23 14:18

Last modified: 2025-08-25 07:05

Author: Henry Rzepa

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Gaussian 16 (C01) calculation

Files

FilenameSizeTypeDescription
N2F2.gjf 459 chemical/x-gaussian-input Gaussian input file
N2F2.log 253KB chemical/x-gaussian-log Gaussian log file
checkpoint.fchk 843KB chemical/x-gaussian-checkpoint Formatted checkpoint file
opt.cml 643 chemical/x-cml Optimised geometry

Member of collection / collaboration

DOIDescription
10.14469/hpc/333 blog

Subject Keywords

KeywordValue
inchi InChI=1S/F2N2/c1-3-4-2
inchikey DUQAODNTUBJRGF-UHFFFAOYSA-N

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