[Pw_forum] help

Dear Anik shrivastava, I do not fully understand your questions, but small comments: So far as I remember the system of eight atoms of silicon is not stable in the diaomd structure if using only the Gamma point; this might thus lead to an increase of the ionic temperature. If the ionic

[Pw_forum] help

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[Pw_forum] Problem in running and saving programmes in pwgui

hellchildsite.menubar.menubar.file.menu invoke active" > ("uplevel" body line 1) > invoked from within > "uplevel #0 [list $w invoke active]" > (procedure "tk::MenuInvoke" line 50) > invoked from within > "tk::MenuInvoke .gui0.shellchildsite.menubar.menubar.file.menu 1" > (command bound to the event) > > > > Regards > Priya > > ___ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140611/9b978173/attachment.html

[Pw_forum] How to fixed the valence of atom

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[Pw_forum] Problem in running and saving programmes in pwgui

ine 1) invoked from within "uplevel #0 [list $w invoke active]" (procedure "tk::MenuInvoke" line 50) invoked from within "tk::MenuInvoke .gui0.shellchildsite.menubar.menubar.file.menu 1" (command bound to the event) Regards Priya -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140611/a87c766c/attachment.html

[Pw_forum] Installing QE-5.0.3 with ifort- iotk error- reg.,

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[Pw_forum] Installing QE-5.0.3 with ifort- iotk error- reg.,

ror 2 > slave2 at slave2:~/espresso$ > > How to resolve this problem > > thank you in advance > > * > > *Muthu.V ?Project Fellow ?Madurai Kamaraj University* > > * > > ___ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -- Dr. Axel Kohlmeyer akohlmey at gmail.com http://goo.gl/1wk0 College of Science & Technology, Temple University, Philadelphia PA, USA International Centre for Theoretical Physics, Trieste. Italy. -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140611/1bd98e3c/attachment.html

[Pw_forum] Problem with Installing Quantum Espresso 5.1.

On Tue, Jun 10, 2014 at 5:02 PM, Paolo Giannozzi wrote: > On Tue, 2014-06-10 at 20:05 +, Goytia, Michael wrote: > > > > "if 'make' is not a typo you can use command-not-to found to look up > > packages that contain it like this, cnf make" > > > what am I doing wrong in the installation > >

[Pw_forum] Problem with Installing Quantum Espresso 5.1.

On Tue, 2014-06-10 at 20:05 +, Goytia, Michael wrote: > "if 'make' is not a typo you can use command-not-to found to look up > packages that contain it like this, cnf make" > what am I doing wrong in the installation apparently your computer has no "make" utility installed. Usually "make"