[Pw_forum] Fwd: Call for candidacy at PIIM Laboratory - CNRS position

> From: Yves Ferro > Date: December 7, 2012 9:16:13 GMT+01:00 > Subject: Call for candidacy at PIIM Laboratory - CNRS position > > > Dear QE users, > > The PIIM Laboratory, Marseille, France, seeks candidates for a > permanent position in the area of atomic-scale modeling of > condensed

[Pw_forum] set_hubbard_l.f90

SH, IISER Pune, First floor, Central Tower, Sai Trinity Building Garware Circle, Sutarwadi, Pashan Pune, Maharashtra 411021, India Phone: +91 (20) 2590 8203 Fax: +91 (20) 2589 9790 -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/808a026f/attachment-0001.html

[Pw_forum] set_hubbard_l.f90

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[Pw_forum] problems with examples for bands.x

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[Pw_forum] Further reduce disk IO for ph.x

On Fri, 2012-12-07 at 17:25 +1100, Yao Yao wrote: > For these disk IO, is it writing output files or swapping out data to save > RAM? the code writes to file in order to save both RAM and CPU time. In particular, it keeps in memory at a given time only data (\psi(k), \psi(k+q), \delta

[Pw_forum] Further reduce disk IO for ph.x

Dear All, I have been working with a lot of phononic calculations with ph.x. It worked very well. However, ph.x do a lot of writing. On a 48-core compute node, it takes ~35MB/s disk IO band width (estimated from network traffic of that node, which is without local disk). I tried "reduce_dio"

[Pw_forum] Compute Debye temperature

ttp://clpm.ecnu.edu.cn/> East China Normal University <http://www.ecnu.edu.cn/english/> Phone: +86-18321726131 I will persist until I succeed! -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/5fa0fe02/att

[Pw_forum] (no subject)

ttp://clpm.ecnu.edu.cn/> East China Normal University <http://www.ecnu.edu.cn/english/> Phone: +86-18321726131 I will persist until I succeed! -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/ae6aebe2/attachment.html

[Pw_forum] old references for examples

On Wed, 2012-12-05 at 18:58 -0500, David Strubbe wrote: > If you could provide reference results in the release that were from > the current version, it would be much easier to decide whether there > are any actual problems being detected or not. I am currently updating reference results for

[Pw_forum] set_hubbard_l.f90

fo/pw_forum > -- Burak Himmetoglu Post-Doctoral Research Associate University of Minnesota MN, USA -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/70a97f95/attachment.html

[Pw_forum] polarizability calculation

delnikova Nikolaev Institute of Inorganic Chemistry of SB RAS -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/f4f0506a/attachment.html

[Pw_forum] polarizability calculation

On Fri, 2012-12-07 at 11:45 +0700, Olga Sedelnikova wrote: > The other problem is connected with the example34. vdw.x is unmantained and longer distributed. P. -- Paolo Giannozzi, IOM-Democritos and University of Udine, Italy

[Pw_forum] Compute Debye temperature

gt; > > > > ___ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum > -- Dept. of Physics Michigan Technological University 1400 Townsend Drive Houghton MI 49931, USA ------ next

[Pw_forum] binding energy for bundle nanotubes

? with regards, khodadad -- next part -- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20121207/859e6a66/attachment.html