Search found 3 matches
- Thu May 26, 2016 7:25 am
- Forum: VTSTTools
- Topic: Question about split_dos
- Replies: 3
- Views: 12587
Re: Question about split_dos
[quote="graeme"]If you can post the directory with the data, I'll try to reproduce the problem and find a solution.[/quote] I checked the script "dosanalyze.pl ", and I found the error message is related to the variance. 290 $eneavg = $dstsum/$dossum; 291 $enevar = ($dssqsum*$dos...
- Wed May 25, 2016 9:33 am
- Forum: VTSTTools
- Topic: Question about split_dos
- Replies: 3
- Views: 12587
Question about split_dos
Hello, Recently, I downloaded the scripts "vtstscripts.tgz". I calculated d-band center of Pt surface with this, and I got the results below. Only Emax is different in the case (1) and the case (2). I do not understand the meaning of the last message,"Can't take sqrt of -415.985 at /b...
- Wed May 25, 2016 8:41 am
- Forum: VTSTTools
- Topic: Question about dosanalyze.pl
- Replies: 28
- Views: 66254
Re: Question about dosanalyze.pl
To graeme,
For the pradeep's question below, is "$ dosanalyze.pl e=-12.2,2.2 a 1-9" right?
I am not sure, but I think "$ dosanalyze.pl e=-12.2,2.2 d 1-9" or " or "$ dosanalyze.pl e=-12.2,2.2 1-9" is right.
Am I right?
For the pradeep's question below, is "$ dosanalyze.pl e=-12.2,2.2 a 1-9" right?
I am not sure, but I think "$ dosanalyze.pl e=-12.2,2.2 d 1-9" or " or "$ dosanalyze.pl e=-12.2,2.2 1-9" is right.
Am I right?