[Pw_forum] about neb

Wu Rongqin g0203654 at nus.edu.sg
Mon Jun 7 14:54:12 CEST 2004

Dear dr. Paolo,

Can you tell me how?



-----Original Message-----
From: pw_forum-admin at pwscf.org [mailto:pw_forum-admin at pwscf.org] On Behalf Of Paolo Giannozzi
Sent: 2004年6月7日 18:32
To: pw_forum at pwscf.org
Subject: Re: [Pw_forum] about neb

On Monday 07 June 2004 07:09, Wu Rongqin wrote:

> is it possible to calculate the norm modes of SiH4 absorbed on a surface?

of course it is, but it may be difficult to get reliable estimates for typical
measured quantites, i.e. changes in frequencies and cross sections
upon adsorption 

Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
Scuola Normale Superiore    Phone:   +39/050-509876, Fax:-563513 
Piazza dei Cavalieri 7      I-56126 Pisa, Italy
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