compat:programs
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compat:programs [2014/10/19 18:31] – [Crystalline Structures] Matteo Giantomassi | compat:programs [2020/08/10 20:17] (current) – [Databases] Xavier Gonze | ||
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VESTA runs on Windows, Mac OS X, and Linux. It is contributed free of charge for non-commercial users. | VESTA runs on Windows, Mac OS X, and Linux. It is contributed free of charge for non-commercial users. | ||
- | [[http:// | + | [[http:// |
designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, | designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, | ||
materials science, and related areas. | materials science, and related areas. | ||
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It runs on GNU/Linux, MAC OSX (requires X11) and Windows (requires CYGWIN). | It runs on GNU/Linux, MAC OSX (requires X11) and Windows (requires CYGWIN). | ||
- | ===== Lectures ===== | ||
- | [[http:// | ||
- | "A primer in Density Functional Theory" | ||
- | 2003, XIII,256p., Hardcover, Springer (ISBN: 3-540-03083-2) | ||
- | [[http:// | ||
- | [[http:// | ||
- | ===== Crystalline Structures ===== | ||
- | [[http:// | ||
- | contains symmetry information and k-vector notations for all the 230 space groups | ||
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- | [[http:// | ||
- | from Mineralogical Society of America, http:// | ||
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- | [[http:// | ||
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- | [[http:// | ||
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- | Useful URL list: http:// | ||
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- | [[http:// | ||
- | The free part of the excellent database is small (3,325 out of 76,480 in 2004), still it may be useful. | ||
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- | [[http:// | ||
- | for Crystallography are available at the [[http:// | ||
- | You might also be interested in some hyperlinks there. | ||
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- | About [[http:// | ||
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- | [[http:// | ||
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- | The [[http:// | ||
- | ===== Phonons ===== | ||
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- | The phonon dispersion curves of metals are collected in Landolt-Boernstein Tables, | ||
- | volume 13, subvolume a, by P.H. Dederichs, H. Schober, D.J.Sellmyer (1981) | ||
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- | Book of Bilz and Kress edited by Springer Verlag | ||
- | See http:// | ||
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- | ===== Periodic Table ===== | ||
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- | The following URL might help, when you would like to check the periodic table of | ||
- | the elements via internet: http:// | ||
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- | [[http:// | ||
- | The source (epte.tar.gz, | ||
- | ===== Databases ===== | ||
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- | [[http:// | ||
- | for electronic structure calculations by Svetlana Kotochigova, | ||
- | and Charles Clarck. | ||
- | The table of " | ||
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- | Web site about ab initio calculations of material properties | ||
- | http:// | ||
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- | [[http:// | ||
- | Images available in the Periodic Table | ||
- | T.-S. Choy, J. Naset, J. Chen, S. Hershfield, and C. Stanton. | ||
- | A database of fermi surface in virtual reality modeling language (vrml). | ||
- | Bulletin of The American Physical Society, 45(1):L36 42, 2000. | ||
compat/programs.1413736298.txt.gz · Last modified: 2014/10/19 18:31 by Matteo Giantomassi