E_File_10 - Free-Base Porphyrin 'Distal' Structure Potential Energy Surface Explorer.cdf

Access status:

Open Access

Field	Value	Language
dc.contributor.author	Canfield, Peter John
dc.date.accessioned	2022-11-02T05:49:55Z
dc.date.available	2022-11-02T05:49:55Z
dc.date.issued	2022-11-02
dc.identifier.uri	https://hdl.handle.net/2123/29672
dc.description.abstract	Mathematica computable document format as described in Chapter 6 and Appendix F. Can be executed in Mathematica or using the free Wolfram Player	en
dc.format.medium	Mathematica computable document format	en
dc.language.iso	en	en
dc.rights	Creative Commons Attribution-NonCommercial 4.0	en
dc.subject	free-base porphyrin	en
dc.subject	tautomerism	en
dc.title	E_File_10 - Free-Base Porphyrin 'Distal' Structure Potential Energy Surface Explorer.cdf	en
dc.type	Software	en
dc.subject.asrc	03 Chemical Sciences	en
dc.subject.asrc	0305 Organic Chemistry	en
dc.subject.asrc	0306 Physical Chemistry (incl. Structural)	en
dc.subject.asrc	0307 Theoretical and Computational Chemistry	en
dc.relation.arc	DP0666378
dc.relation.arc	DP0773847
dc.relation.arc	DP150103137
dc.description.method	See Thesis chapter 6 and Appendix F for details	en
dc.relation.other	Research Training Program Stipend (SC1999)
dc.relation.other	Shanghai High-End Foreign Experts Grant
dc.relation.other	National Natural Science Foundation of China (NSFC; grant no. 11674212)
dc.relation.other	National Computational Infrastructure (NCI, d63)
dc.relation.other	INTERSECT (r88)
usyd.faculty	SeS faculties schools::Faculty of Science::School of Chemistry	en
workflow.metadata.only	No	en