Direct evidence of O(p) holes in Li-doped NiO from Hartree-Fock calculations

Title:	Direct evidence of O(p) holes in Li-doped NiO from Hartree-Fock calculations
Authors:	Mackrodt, WC Harrison, NM Saunders, VR Allan, NL Towler, MD
Item Type:	Journal Article
Issue Date:	16-Feb-1996
Citation:	CHEM PHYS LETT Vol.( 250 ) No.( 1 ) pp 66 - 70
URI:	http://hdl.handle.net/10044/1/615
Publisher Link:	http://dx.doi.org/10.1016/0009-2614(95)01415-2
ISSN:	0009-2614
Start Page:	66
End Page:	70
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 250, issue 1 (16 February 1996). doi:10.1016/0009-2614(95)01415-2.
Volume:	250
Appears in Collections:	Computational and Structural Research Group