Re: [Wien] nnn too small

Okay sir i'll try to update the latest version. Thank you for your help Afiq Radzwan, Master of philosophy(Physics) candidate Department of Physics, Faculty of Science, Universiti Teknologi Malaysia, 81310 UTM Johor Bahru, JOHOR, MALAYSIA. af...@live.utm.my afiqradzwan1...@gmail.com +601112108576

Re: [Wien] nnn too small

but sir even I change dlimit & dstmax with different value such as 0.5,1 and 20, the result is still the same Afiq Radzwan, Master of philosophy(Physics) candidate Department of Physics, Faculty of Science, Universiti Teknologi Malaysia, 81310 UTM Johor Bahru, JOHOR, MALAYSIA

[Wien] nnn too small

? and how to fix it? I have SEARCHED the archives AND READ THE USERS GUIDE and the FAQ pages, but I couldn't solve my problem. Thanks and regards Afiq Radzwan, Doctor of philosophy(Physics) candidate Department of Physics, Faculty of Science, Universiti Teknologi Malaysia, 81310 UTM Johor Bahru

[Wien] XC-functional Option 15 in version 16

in version 13 same in version 16? 2) is there any way to use the numerical format to define XC- functional as in version 13? I have SEARCHED the archives AND READ THE USERS GUIDE and the FAQ pages, but I couldn't solve my problem. Thanks and regards Afiq Radzwan, Doctor of philosophy(Physics

Re: [Wien] Problem with structure construction

Dear Prof. Blaha *,*Thank you very much for your information. Thanks and regards Afiq Radzwan, Universiti Teknologi Malaysia. On Tue, Feb 21, 2017 at 8:05 PM, Peter Blaha <pbl...@theochem.tuwien.ac.at> wrote: > If I understand you correctly, your unit cell has already 20 atoms,

[Wien] Problem with structure construction

and regards Afiq Radzwan, Universiti Teknologi Malaysia, ___ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at