Int-1

DOI: 10.14469/hpc/12127 Metadata

Created: 2022-12-23 13:43

Last modified: 2022-12-23 14:00

Author: Joe I. Higham

License: Creative Commons: Public Domain Dedication 1.0

Funding: (none given)

Description

Int-1

Embargo

Access code: g2qm-vmkv

Release embargo

Files

FilenameSizeTypeDescription
Int-1.chk 15MB chemical/x-gaussian-checkpoint
Int-1.com 1KB application/x-msdos-program
Int-1.log 637KB chemical/x-gaussian-log

Member of collection / collaboration

DOIDescription
10.14469/hpc/12036 DFT computational data

Subject Keywords

KeywordValue
inchi InChI=1S/C9H13N/c1-9(2,10)8-6-4-3-5-7-8/h3-7H,10H2,1-2H3
inchikey KDFDOINBXBEOLZ-UHFFFAOYSA-N

Edit