2012 2012 Practice

2014.03.19 21:21

관리자 Views:12783

Practice #1

Tutorial for pseudopotetial generation.

 

Practice #2

Cutoff, k-points, lattice constant vs. Energy

 

Practive #3

How to make DOS, band structure and wave function using pwscf.

 

Practice #4

Making the supercell and supercell with defects.

Calculating the defect formation energy.

 

Practice #5

Spin-polarized calculation of oxygen molecule and bcc iron.

No. Subject Author Date Views
13 2015 Practice #3~4 file 관리자 2015.11.06 11331
12 2015 Practice #0~2 file 관리자 2015.09.11 11559
11 2013 Practice file 관리자 2014.03.19 11445
10 2013 Syllabus file 관리자 2014.03.19 11266
» 2012 Practice file 관리자 2014.03.19 12783
8 2011 Syllabus file 관리자 2014.03.19 11170
7 2010 Practice 관리자 2014.03.19 12613
6 2010 vasp visualization file 관리자 2014.03.19 12874
5 2010 A Demonstration of how to use XCrySDen file 관리자 2014.03.19 13868
4 2010 Syllabus file 관리자 2014.03.19 14115
3 2009 Lecture Material_2 file 관리자 2014.03.19 11848
2 2009 Lecture Material file 관리자 2014.03.19 12273
1 2009 Syllabus file 관리자 2014.03.19 11336