forum@abinit.org
Subject: The ABINIT Users Mailing List ( CLOSED )
List archive
- From: whoming@sohu.com
- To: forum@abinit.org
- Subject: Re: on the number of IR-active modes in Y2O2S
- Date: Wed, 24 May 2006 11:19:25 +0200
Some corrections:
When E//c, the 2 Au modes become Mode 9 (360.9 cm-1) and Mode 15 (587.4 cm-1)
in the output of anaddb, comparing with those in E//a,b case being Mode 9
(315.3 cm-1) and Mode 10 (475.2 cm-1), respectively.
When E//c, the 4 Eu mode Modes become Mode 6 and Mode 7 (degenerate with
235.7 cm-1), and Mode 10 and Mode 11 (degenerate with 485.2 cm-1), comparing
with those in E//a,b case being Mode 6 (TO, 235.7 cm-1) and Mode 7(LO, 266.3
cm-1), and Mode 11 (TO, 485.2 cm-1) and Mode 15 (LO, 599.6 cm-1)
- on the number of IR-active modes in Y2O2S, whoming, 05/24/2006
- Re: [abinit-forum] on the number of IR-active modes in Y2O2S, Masayoshi Mikami, 05/24/2006
- <Possible follow-up(s)>
- Re: on the number of IR-active modes in Y2O2S, whoming, 05/24/2006
Archive powered by MHonArc 2.6.16.