Please use this identifier to cite or link to this item: http://hdl.handle.net/10316/5252
Title: On the behavior of single-surface nuclear wavefunctions in the vicinity of the conical intersection for an X3 system
Authors: Varandas, A. J. C. 
Xu, Z. R. 
Issue Date: 2000
Citation: Chemical Physics Letters. 316:3-4 (2000) 248-256
Abstract: The behavior of single-surface nuclear wavefunctions in the vicinity of the conical intersection at the equilateral triangle conformations of homonuclear triatomic systems is examined analytically by using spherical coordinates which are obtained from the usual D3h normal mode ones. They are described by a set of three quantum numbers and shown to approach zero at the conical intersection, irrespective of whether the so-called geometric phase effects are taken into consideration.
URI: http://hdl.handle.net/10316/5252
DOI: 10.1016/S0009-2614(99)01275-0
Rights: openAccess
Appears in Collections:FCTUC Química - Artigos em Revistas Internacionais

Files in This Item:
File Description SizeFormat
fileba6a1efd52234ec9bbb9f1f69676b1c9.pdf548.19 kBAdobe PDFView/Open
Show full item record

WEB OF SCIENCETM
Citations

23
checked on Apr 2, 2021

Page view(s)

168
checked on Jul 29, 2021

Download(s)

135
checked on Jul 29, 2021

Google ScholarTM

Check

Altmetric

Altmetric


Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.