Apologies if this is old news to some, but something for the inorganic / intermetallic types : the "Structure Tidy" program is available within Ton Spek's...
Dear all, I'm trying to calculate some cavity volumes using VOLCAL and i'm having some problems trying to make the program understand what i want. Could...
Gerard, Garcia S
gsg2@...
Jun 6, 2005 9:29 am
1673
Talk notes of the ACA 2005 powder workshop held in Orlando Florida on Saturday 28th May 2005 are now available in PDF format on the web : as a single...
Dear Sirs, Please take note of the enclosed Marie Curie vacancies available in Bari. http://sdpd.univ-lemans.fr/TrainingSite_Locandina.html If you know someone...
Hi, New listserver announced below. Not yet any software using the pair distribution function for structure solution in direct space ? RMCA does it for...
Forwarded on behalf of Michal Husak ( Michal.Husak@... ) ... Dear colleagues I would like to inform you, that we had made available an improved version...
This message is mainly for crystallographers based in Canada (though others may be interested in the crystallographic artwork of Francois Brisse (as used in...
Hi All, anybody using Filmscan software by Materialsdata? Is it best/worst, cheaper ..... than other similar Windows based software? What is your opinion of...
Natale Perchiazzi
natale@...
Jun 24, 2005 1:02 pm
1679
Stop software patents New campaign in Europe: http://sdpd.univ-lemans.fr/ Armel...
Dear all, The 2nd reading of the software patent directive at the European Parliament is IN ONE WEEK. Debate on the 5th, vote on the 6th of july. QUICK RESUME:...
Favre-Nicolin Vincent
vincefn@...
Jun 28, 2005 9:29 am
1681
Hello All, I am currently trying to solve the structure of an unknown Cu compound using FOX. The problem I am having is that although I am conviced that I...
António Moreira d...
antonio@...
Jun 28, 2005 10:34 am
1682
... A. Altomare, M.C. Burla, G. Cascarano, C. Giacovazzo, A. Guagliardi, A.G.G. Moliterni and G. Polidori (1996), "Early Finding of Preferred Orientation:...
Jacco van de Streek
streek@...
Jun 28, 2005 11:33 am
1683
Dear António, ... Have you imposed the Cu-O coordination by using a description from Cu polyhedra ? Or are you using Cu and O atoms ? Checking the structure...
Favre-Nicolin Vincent
vincefn@...
Jun 28, 2005 12:08 pm
1684
... Actually, this topic was discussed several times in SDPD/Rietveld lists. My "duty advice" is: When the structure model is absent or incomplete, one can...
Dear all, Bruker AXS is seeking an X-ray powder diffraction application scientist in Karlsruhe, Germany. We expect particular skills in the area of structure...
Kern, Arnt A.
arnt.kern@...
Jun 29, 2005 2:16 pm
1686
REF. PDID31-2 The ESRF is a multinational research institute, situated in Grenoble, France and financed by 18 countries mostly European. It operates a powerful...
... derive the zero shift on a diffraction pattern by harmonic analysis without an internal standard, is there a way to derive a possible preferred orientation...
Jon Wright
wright@...
Jun 30, 2005 8:06 am
1688
Antonio, You may read this: http://www.ecole.ensicaen.fr/~chateign/texture/combined.pdf for preferred orientations it might help, tell me daniel ... -- Daniel...
Daniel Chateigner
daniel.chateigner@...
Jul 4, 2005 11:33 am
1689
Hi, Calculations on PC taking advantage from parallelism will obtain speed improvement in the next years (or even now) in spite of the limitation to < 4GhZ for...
... Not me. But for direct-space SDPD, you do not necessarily need a multi-core application, as long as the algorithm is 'stupid' and does not learn from other...
Favre-Nicolin Vincent
vincefn@...
Jul 4, 2005 1:02 pm
1691
Thanks to Vincent for his pointer towards our recent paper on using distributed computing to speed up coarse-grained HMC calculations in an SDPD context. Our...
Dear Colleague, Starting from cycle 2004/03 (April-May 2005), ISIS has started to offer a "Measure-by-Courier" powder diffraction access mechanism to the GEM ...
Dear all, Today the software patent directive has been rejected by the EU Parliament, with a large majority. You can read more information about this on: ...
Favre-Nicolin Vincent
vincefn@...
Jul 6, 2005 1:22 pm
1694
Dear all, Could anybody help me to got the Crystal Structure of Creatine Monohydrate if exist. I do not find in PDF2 database and I do not have the CSD...
mrukiah
mrukiah@...
Jul 6, 2005 2:07 pm
1695
Many thanks to everybody who has contributed to this result, especially to Vincent. Radovan ... -- Radovan Cerny Laboratoire de Cristallographie 24, quai...
... It's in the CSD. I can't send the structure to the whole list, but I will send it to your e-mail address. Best wishes, -- Dr Jacco van de Streek Research...
Jacco van de Streek
streek@...
Jul 7, 2005 2:56 am
1697
On behalf of Prof. Ross Angel: Dear Colleagues, A postdoctoral position is available to work on the project CEAD (COMPRES Environment for Automated Data...
Vincent Favre-Nicolin
vincefn@...
Jul 8, 2005 8:27 pm
1698
Dear all, I have some questions: 1) Is there any way to get the software package Powsim, or LSQPROF or Dorees? 2) How can I modify the output file extra.hkl...
JMGALIAN.teleline.es
jmgalian@...
Jul 14, 2005 7:07 pm
1699
... Never seen them in free access... ... Write some translation software. Should be obvious, if not, use SHELX... ... From the ESPOIR manual: if nobt = 2 :...
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