Re: Freq visualisation?

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Re: Freq visualisation?

From: Carles Bo Jane <bo_at_email.domain.hidden>
Date: Fri, 10 Nov 2000 14:32:48 +0100
X-Mailer: QUALCOMM Windows Eudora Light Version 3.0.3 (32)

 Hi Stuart,
 
>We have been considering the same problem and have been playing around
>with the dmpkf and udmpkf utilities to translate ADF2000 TAPE21 files
>into versions compatible with ADF2.3 (for which frequency visualisation
>works well with MOLDEN). Has anyone else been down this road
>(successfully or otherwise)?
>

 Yes, we solved this problem recently. You must modify the udmpkf 2.3 code
in order to read the 160 bytes long character variables from ADF2000 and
write them as 80 bytes long character variables. In this way, you can
dmpkf an ADF2000 TAPE21 file and udmpkf it to an ADF2.3 TAPE21 file.

Hope it helps !!

Carles
 

________________________________________________________________

  Carles Bo
  Dept. de Quimica Fisica i Inorganica
  Universitat Rovira i Virgili Voice (34) 977 55 95 69
  Pl. Imperial Tarraco, 1 FAX (34) 977 55 95 63
  43005 - Tarragona
  SPAIN http://www.quimica.urv.es/~w3qfi
                       http://quimica.urv.es/cgi-bin/card?bo+qfi
________________________________________________________________
Received on 2000-11-10 17:32:03

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