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force gradually increase in NEB run
by gump_813 » Fri Sep 18, 2009 11:12 pm in VTSTTools - 0
- 33
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by gump_813
Fri Sep 18, 2009 11:12 pm
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force gradually increase in NEB run
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Transition state with electric field
by ftb » Thu Sep 10, 2009 3:23 pm in VTSTTools - 0
- 39
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by ftb
Thu Sep 10, 2009 3:23 pm
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Transition state with electric field
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Charge Density Difference plotting
by gpkmohan » Thu Sep 03, 2009 9:53 am in VTSTTools - 0
- 99
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by gpkmohan
Thu Sep 03, 2009 9:53 am
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Charge Density Difference plotting
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about gold surfaces optimization
by Cesar » Wed Aug 05, 2009 10:09 pm in tsse - 0
- 48
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by Cesar
Wed Aug 05, 2009 10:09 pm
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about gold surfaces optimization
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Problem runing Dimer
by graeme » Tue Jul 28, 2009 2:23 pm in VTSTTools - 0
- 54
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by graeme
Tue Jul 28, 2009 2:23 pm
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Problem runing Dimer
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about lanczos again
by hakuna » Thu May 28, 2009 1:00 pm in VTSTTools - 0
- 44
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by hakuna
Thu May 28, 2009 1:00 pm
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about lanczos again
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coop scripts
by hakuna » Thu May 28, 2009 12:56 pm in VTSTTools - 0
- 92
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by hakuna
Thu May 28, 2009 12:56 pm
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coop scripts
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Bader and .cube files of non-orthogonal cells
by ymantz » Fri Mar 06, 2009 11:10 pm in Bader - 0
- 159
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by ymantz
Fri Mar 06, 2009 11:10 pm
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Bader and .cube files of non-orthogonal cells
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Who can send me a small sample of CI_NEB calculation?
by LiangZhang » Sat Feb 21, 2009 1:19 am in VTSTTools - 0
- 116
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by LiangZhang
Sat Feb 21, 2009 1:19 am
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Who can send me a small sample of CI_NEB calculation?
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NEB result strange
by victory2401 » Thu Jan 08, 2009 3:32 am in VTSTTools - 0
- 142
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by victory2401
Thu Jan 08, 2009 3:32 am
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NEB result strange
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about NEB convergence
by lanjh » Thu Jan 03, 2008 8:40 am in VTSTTools - 0
- 483
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by lanjh
Thu Jan 03, 2008 8:40 am
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about NEB convergence
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Please ignore the question
by bai » Wed Oct 10, 2007 7:45 am in Bader - 0
- 685
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by bai
Wed Oct 10, 2007 7:45 am
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Please ignore the question
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How to edit main.F
by bai » Wed Oct 10, 2007 5:30 am in Bader - 0
- 596
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by bai
Wed Oct 10, 2007 5:30 am
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How to edit main.F
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new scprits for doslanalyze.pl and doslplot.pl
by Wenjie » Sat Aug 04, 2007 3:29 am in VTSTTools - 0
- 641
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by Wenjie
Sat Aug 04, 2007 3:29 am
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new scprits for doslanalyze.pl and doslplot.pl
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Problem of energy gradiance still exists
by staar » Wed Jun 20, 2007 7:47 am in VTSTTools - 0
- 630
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by staar
Wed Jun 20, 2007 7:47 am
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Problem of energy gradiance still exists
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propositions for new versions
by vozny » Thu Mar 01, 2007 3:44 am in Bader - 0
- 818
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by vozny
Thu Mar 01, 2007 3:44 am
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propositions for new versions
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Why flow in neb.F can not proceed in my calculations?
by phydig » Sat Dec 09, 2006 10:46 am in VTSTTools - 0
- 616
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by phydig
Sat Dec 09, 2006 10:46 am
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Why flow in neb.F can not proceed in my calculations?
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Bader volume to RWIGS in VASP
by phtobias » Wed Jun 28, 2006 9:13 am in Bader - 0
- 1230
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by phtobias
Wed Jun 28, 2006 9:13 am
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Bader volume to RWIGS in VASP
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updated diffcon.pl
by graeme » Sat Jun 03, 2006 3:20 am in VTSTTools - 0
- 771
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by graeme
Sat Jun 03, 2006 3:20 am
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updated diffcon.pl
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05-11-22 Change to CVS version
by Andreas Pedersen » Tue Nov 22, 2005 3:52 pm in EON - 0
- 1271
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by Andreas Pedersen
Tue Nov 22, 2005 3:52 pm
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05-11-22 Change to CVS version
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05-08-27 Change to CVS version
by Andreas Pedersen » Wed Aug 31, 2005 9:02 am in EON - 0
- 1241
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by Andreas Pedersen
Wed Aug 31, 2005 9:02 am
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05-08-27 Change to CVS version
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05-08-20 Change to CVS version
by graeme » Sat Aug 20, 2005 6:37 am in EON - 0
- 1196
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by graeme
Sat Aug 20, 2005 6:37 am
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05-08-20 Change to CVS version
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05-08-18 Change to CVS version
by graeme » Fri Aug 19, 2005 4:42 am in EON - 0
- 1181
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by graeme
Fri Aug 19, 2005 4:42 am
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05-08-18 Change to CVS version
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05-08-18 Change to CVS version
by Andreas Pedersen » Thu Aug 18, 2005 5:05 pm in EON - 0
- 1160
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by Andreas Pedersen
Thu Aug 18, 2005 5:05 pm
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05-08-18 Change to CVS version
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05-08-11 Change to CVS version
by Andreas Pedersen » Thu Aug 11, 2005 11:18 am in EON - 0
- 1194
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by Andreas Pedersen
Thu Aug 11, 2005 11:18 am
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05-08-11 Change to CVS version
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05-08-09 Change to CVS version
by Andreas Pedersen » Wed Aug 10, 2005 12:31 pm in EON - 0
- 1251
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by Andreas Pedersen
Wed Aug 10, 2005 12:31 pm
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05-08-09 Change to CVS version
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Bader source updated
by andri » Thu Aug 04, 2005 5:29 pm in Bader - 0
- 1177
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by andri
Thu Aug 04, 2005 5:29 pm
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Bader source updated
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05-08-03 Change to CVS version
by Andreas Pedersen » Wed Aug 03, 2005 11:43 am in EON - 0
- 1277
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by Andreas Pedersen
Wed Aug 03, 2005 11:43 am
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05-08-03 Change to CVS version
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Web page and tar.gz file updates
by graeme » Tue May 24, 2005 2:34 am in VTSTTools - 0
- 1074
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by graeme
Tue May 24, 2005 2:34 am
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Web page and tar.gz file updates
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vaspview binary for tiger
by graeme » Wed May 18, 2005 7:52 pm in Bader - 0
- 1382
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by graeme
Wed May 18, 2005 7:52 pm
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vaspview binary for tiger
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Updated lanczos.F
by andri » Mon May 16, 2005 8:03 pm in VTSTTools - 0
- 1080
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by andri
Mon May 16, 2005 8:03 pm
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Updated lanczos.F
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What is this project?
by graeme » Sun May 15, 2005 12:01 am in tsse - 0
- 1532
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by graeme
Sun May 15, 2005 12:01 am
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What is this project?
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