You are here: start » wien

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

wien [2014/05/21 11:56] – danielwien [2020/03/06 09:12] (current) – external edit 127.0.0.1
Line 1: Line 1:
 +In previous years, we used Wien 2k rather than OpenMX to do the class DFT project. This old page is available because some of the FAQ are relevant, and there is some info about XCrysDen and unix that may be useful.  
 +
 ====== WIEN 2k Basic Instructions for PH575 students ====== ====== WIEN 2k Basic Instructions for PH575 students ======
 Wien 2k is a commercial program that calculates dispersion relations, density of states, partial density of states, and other properties of crystalline solids.  The program is named Wien 2k (pronounced "VEEN-2-kay") because it was developed by physicists in Vienna, Austria ("Vienna" is the English version of the German "Wien"), and the most recent modification of the program was in the year 2000.  More information about the program is at the developers' website http://www.wien2k.at. Wien 2k is a commercial program that calculates dispersion relations, density of states, partial density of states, and other properties of crystalline solids.  The program is named Wien 2k (pronounced "VEEN-2-kay") because it was developed by physicists in Vienna, Austria ("Vienna" is the English version of the German "Wien"), and the most recent modification of the program was in the year 2000.  More information about the program is at the developers' website http://www.wien2k.at.
Line 8: Line 10:
   * Also see {{:tutorial_fixed.pdf|Andrew Stickel's tutorial}}, which covers more details on setting up Wien on windows machines.  He is a former student who really got into the program and many of the sub programs.   * Also see {{:tutorial_fixed.pdf|Andrew Stickel's tutorial}}, which covers more details on setting up Wien on windows machines.  He is a former student who really got into the program and many of the sub programs.
  
-Prof. Guenter Schneider and I are also working to implement a more user-friendly interface using //flair//, the DFT code Dr. Schneider has written, and //gem//, a Python-based graphical interface.  If you wish to be a guinea-pig for the flair/gem option, let me know **Flair/gem option not in 2014**.+Prof. Guenter Schneider and I are also working to implement a more user-friendly interface using //flair//, the DFT code Dr. Schneider has written, and //gem//, a Python-based graphical interface.
  
 ===== Computer Accounts ===== ===== Computer Accounts =====

Trace:

QR Code
QR Code wien (generated for current page)