User contributions for 10.0.7.15

23 January 2017

• 11:1711:17, 23 January 2017 diff hist +92 Enter No edit summary
• 11:1611:16, 23 January 2017 diff hist +1 Scripts for VASP →Queue management
• 11:1511:15, 23 January 2017 diff hist +2 Enter No edit summary
• 11:1511:15, 23 January 2017 diff hist +7 Enter No edit summary
• 11:1511:15, 23 January 2017 diff hist −2 Enter No edit summary
• 11:1411:14, 23 January 2017 diff hist +1 Enter No edit summary
• 11:1311:13, 23 January 2017 diff hist +14 Enter No edit summary
• 11:1311:13, 23 January 2017 diff hist +1,000 N Enter New page: Dear all, I wrote two line commands to get into the calculation directories quickly! 1 Please add these two lines in your ~/.bashrc file in tekla2 myfunction() { cd $(qstat -j "$1" ...
• 11:0911:09, 23 January 2017 diff hist +75 Scripts for VASP →Queue management

8 July 2016

• 17:0617:06, 8 July 2016 diff hist +183 Vtotav.py No edit summary
• 17:0317:03, 8 July 2016 diff hist −3,960 Vtotav.py Replacing page with ' Image:Cell.tgz'
• 17:0217:02, 8 July 2016 diff hist +3,979 N Vtotav.py New page: #!/usr/bin/env python """ A script which averages a CHGCAR or LOCPOT file in one direction to make a 1D curve. User must specify filename and direction on command line. Depends on ase """ ...
• 17:0217:02, 8 July 2016 diff hist +105 Scripts for VASP →Visual tools

9 May 2016

• 16:3216:32, 9 May 2016 diff hist +3 Mount MareNostrum folders No edit summary

23 March 2016

• 09:5009:50, 23 March 2016 diff hist +1,475 N Dire2cart.py New page: #!/usr/bin/env python # -*- coding: utf-8 -*- #Convert direct coordinates to cartesian Writen By Qiang import subprocess subprocess.call('rm POSCAR_C -f', shell = True) file_read = open...
• 09:5009:50, 23 March 2016 diff hist +1 Scripts for VASP →Format conversion
• 09:4909:49, 23 March 2016 diff hist +91 Scripts for VASP →Format conversion

5 August 2015

• 13:3513:35, 5 August 2015 diff hist −1 Mount MareNostrum folders No edit summary
• 13:3413:34, 5 August 2015 diff hist −84 Mount MareNostrum folders No edit summary
• 13:3313:33, 5 August 2015 diff hist +2 Mount MareNostrum folders No edit summary
• 13:3313:33, 5 August 2015 diff hist −2 Mount MareNostrum folders No edit summary
• 13:3213:32, 5 August 2015 diff hist +147 Mount MareNostrum folders No edit summary

7 May 2015

• 08:5908:59, 7 May 2015 diff hist +68 Scripts for VASP →Other applications

30 July 2014

• 15:0815:08, 30 July 2014 diff hist 0 Generate figures →2. Script preparation

8 April 2014

• 17:1617:16, 8 April 2014 diff hist +53 Generate figures →3. Printing and post-processing

17 July 2013

• 15:1015:10, 17 July 2013 diff hist 0 Heat map + Numbers + Relative values per line No edit summary current

20 July 2012

• 15:1715:17, 20 July 2012 diff hist +1,586 N Heat map + Numbers + Relative values per line New page: go back to Main Page, Computational Resources, MATHEMATICA, Scripts, Scripts for Mathematica 8 c1 = Import ["path/file.csv"] (*The file.csv must be in the shape [[ma...
• 12:0512:05, 20 July 2012 diff hist +387 Scripts for Mathematica 8 No edit summary

13 September 2011

• 15:3915:39, 13 September 2011 diff hist +50 Legend No edit summary current
• 15:3815:38, 13 September 2011 diff hist +49 Heat map No edit summary current
• 15:3815:38, 13 September 2011 diff hist +49 Matrix No edit summary current
• 15:3815:38, 13 September 2011 diff hist +49 Heat map + legend No edit summary current
• 15:3715:37, 13 September 2011 diff hist +49 Scripts for Mathematica 8 No edit summary
• 15:3715:37, 13 September 2011 diff hist −1 Heat map + legend No edit summary
• 15:3415:34, 13 September 2011 diff hist −8 Heat map + legend No edit summary
• 15:3315:33, 13 September 2011 diff hist −8 Heat map + legend No edit summary
• 15:3315:33, 13 September 2011 diff hist −34 Heat map + legend No edit summary
• 15:3215:32, 13 September 2011 diff hist −26 Heat map + legend No edit summary
• 15:3115:31, 13 September 2011 diff hist +31 Legend No edit summary
• 15:3015:30, 13 September 2011 diff hist +31 Heat map No edit summary
• 15:2915:29, 13 September 2011 diff hist 0 Scripts for Mathematica 8 No edit summary
• 15:2915:29, 13 September 2011 diff hist +15 Scripts for Mathematica 8 No edit summary
• 15:2815:28, 13 September 2011 diff hist +17 Scripts for Mathematica 8 No edit summary
• 15:1615:16, 13 September 2011 diff hist +1 Scripts for Mathematica 8 No edit summary