First-principles molecular dynamics simulation of water dissociation on TiO2(110)

Title:	First-principles molecular dynamics simulation of water dissociation on TiO2(110)
Authors:	Lindan, PJD Harrison, NM Holender, JM Gillan, MJ
Item Type:	Journal Article
Issue Date:	18-Oct-1996
Citation:	CHEM PHYS LETT Vol.( 261 ) No.( 3 ) pp 246 - 252
URI:	http://hdl.handle.net/10044/1/617
Publisher Link:	http://dx.doi.org/10.1016/0009-2614(96)00934-7
ISSN:	0009-2614
Start Page:	246
End Page:	252
Copyright Statement:	© 1996 Elsevier Science B.V. This is the author’s version of a work that was accepted for publication in Chemical Physics Letters. Changes resulting from the publishing process, such as peer review, editing, corrections, structural formatting, and other quality control mechanisms may not be reflected in this document. Changes may have been made to this work since it was submitted for publication. A definitive version was subsequently published in Chemical Physics Letters, volume 261, issue 3 (18 October 1996). doi:10.1016/0009-2614(96)00934-7.
Volume:	261
Appears in Collections:	Computational and Structural Research Group