| dc.contributor.author | Jenkins, S | en_US |
| dc.contributor.author | Xiao, C-X | en_US |
| dc.contributor.author | Xu, T | en_US |
| dc.contributor.author | Yin, D | en_US |
| dc.contributor.author | Kirk, SR | en_US |
| dc.contributor.author | Chass, GA | en_US |
| dc.date.accessioned | 2015-12-09T13:04:31Z | |
| dc.date.issued | 2015-07-15 | en_US |
| dc.identifier.issn | 0020-7608 | en_US |
| dc.identifier.uri | http://qmro.qmul.ac.uk/xmlui/handle/123456789/9712 | |
| dc.description.sponsorship | The One Hundred Talents Foundation of Hunan Province and the aid program for the Science and Technology Innovative Research Team in Higher Educational Institutions of Hunan Province are gratefully acknowledged for the support of S. J. and S. R. K. Thanks also are given to Julio R. Maza for the creation of the artwork for the table of contents. The National Natural Science Foundation of China is also gratefully acknowledged, project approval number: 21273069. G. A. C. thanks the EPSRC, UK (EP/H030077/1 & EP/H030077/2), Royal Society, Cambridge, UK (IE120096) and STFC, UK for support. The authors also acknowledge F. A. Figueredo for preliminary calculations in this work. | en_US |
| dc.format.extent | 875 - 883 | en_US |
| dc.relation.ispartof | INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | en_US |
| dc.rights | This is the peer reviewed version of the following article: Jenkins, Samantha, et al. "Quantum topological resolution of catalyst proficiency." International Journal of Quantum Chemistry (2015), which has been published in final form at http://10.1002/qua.24922. This article may be used for non-commercial purposes in accordance with Wiley Terms and Conditions for Self-Archiving. | |
| dc.subject | QTAIM | en_US |
| dc.subject | catalyst proficiency | en_US |
| dc.subject | quantum topology phase diagrams | en_US |
| dc.subject | reaction pathway | en_US |
| dc.subject | catalyzed cross-coupling | en_US |
| dc.title | Quantum topological resolution of catalyst proficiency | en_US |
| dc.type | Article | |
| dc.identifier.doi | 10.1002/qua.24922 | en_US |
| pubs.author-url | http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000356016300003&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=612ae0d773dcbdba3046f6df545e9f6a | en_US |
| pubs.issue | 14 | en_US |
| pubs.notes | Not known | en_US |
| pubs.publication-status | Published | en_US |
| pubs.volume | 115 | en_US |
