[CP2K:5690] TDDFPT implementation

[hut... at chem.uzh.ch]

Hi

best source is the Thesis of Thomas Chassaing:

Excitation energy calculations with TD-DFT (2005)

An electronic version is online, accessible through the
Zentralbibliothek Zurich.

http://opac.nebis.ch/F/G2I4X9KS9I75Y84DYECJGQJFNLA95591B8KC6SXT4SMB8F727C-05737?func=find-c&local_base=hoch&ccl_term=WAU%3DChassaing&sc1=WAU&sr1=Chassaing&filter_code_1=WLC&filter_request_1=uni-zh+AND+wft%3Delektron+daten+fernzugriff&pds_handle=GUEST

if this link is not working, try google.

regards

Juerg
--------------------------------------------------------------
Juerg Hutter                         Phone : ++41 44 635 4491
Institut für Chemie C                FAX   : ++41 44 635 6838
Universität Zürich                   E-mail: hut... at chem.uzh.ch
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CH-8057 Zürich, Switzerland
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-----cp... at googlegroups.com wrote: -----
To: cp... at googlegroups.com
From: Andrei Buin 
Sent by: cp... at googlegroups.com
Date: 10/01/2014 05:51PM
Subject: [CP2K:5690] TDDFPT implementation

Dear developers,

I found that TDDFPT was implemented using original Casida's work, I was wondering if anybody can point to the implementation paper of the TDFPT in the CP2K article ?

With Best Regards, Andrei Buin.


  
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