[Pw_forum] Re:pw-1.3.0 not compiling in pc_abs (fwd)

Paritosh Modak pmodak at magnum.barc.ernet.in
Fri Sep 19 08:52:10 CEST 2003


---------- Forwarded message ----------
Date: Fri, 19 Sep 2003 12:07:46 +0530 (IST)
From: Paritosh Modak <pmodak at magnum.barc.ernet.in>
To: pw_users at pwscf.org
Subject: Re:pw-1.3.0 not compiling in pc_abs


Dear pw_users,
              I have down loaded the recent 1.3 version of PWSCF code.When
I untar the package I found pw_examples subdirectory is not there. Then I
tried to compile in pc_abs but failed. It gives the error "when declared
implicit none, then the variables should be defined explicitly.

P. Modak

 On Wed, 17 Sep 2003 pw_users-request at pwscf.org wrote:

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> Today's Topics:
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>    1. New PWSCF version (Paolo Giannozzi)
>
> --__--__--
>
> Message: 1
> From: Paolo Giannozzi <giannozz at nest.sns.it>
> Organization: Scuola Normale Superiore di Pisa
> To: pw_users at pwscf.org
> Date: Tue, 16 Sep 2003 14:47:12 +0200
> Subject: [Pw_users] New PWSCF version
> Reply-To: pw_users at pwscf.org
>
> A new version (1.3) of the PWscf package is available for
> download on the web site http://www.pwscf.org. The new
> version contains many changes, improvements, bug fixes.
> Everybody who is using the PWscf package is encouraged
> to upgrade and to report problems to the mailing list.
>
> This release is another step forward towards full integration
> and interoperability of PWscf with the Car-Parrinello codes
> FPMD and CP. The entire updated package is available for
> download from http://www.democritos.it
>
> Major changes:
> - various bug fixes
> - various compilation/installation problems fixed
> - unified installation procedure for all codes
> - external libraries are no longer required
>   (but it may still be convenient to use them)
> - new features:
>   -  Berry phase calculation of polarization
>      (contributed by Vanderbilt group in Rutgers University)
>   -  Calculation of projected DOS
>   -  Possibility to add an external electric field
>   -  Dipolar correction (for surface calculation)
>
> Incompatibilities with previous versions:
> - a make.sys file must be re-generated for your installation
>   (do not just re-use those from v.1.2 !)
> - files produced by preceding versions may be unreadable
>
> --
> Paolo Giannozzi             e-mail:  giannozz at nest.sns.it
> Scuola Normale Superiore    Phone:   +39/050509412
> Piazza dei Cavalieri 7      Fax:     +39/050509417, 050563513
> I-56126 Pisa, Italy         Office:  Lab. NEST, Via della Faggiola 19
>
>
>
> --__--__--
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