Using VASP

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Why my adatom is precipited inside my surface?

Last post by admin « Wed Jan 30, 2013 4:30 pm
Replies: 1
by danith » Mon Jan 07, 2013 11:11 am

1 Replies

2412 Views

Last post by admin
Wed Jan 30, 2013 4:30 pm
Charge density in z-direction

Last post by admin « Wed Jan 30, 2013 4:22 pm
Replies: 1
by Sandra787 » Fri Jan 11, 2013 11:45 am

1 Replies

2749 Views

Last post by admin
Wed Jan 30, 2013 4:22 pm
Potassium atom ground state energy

Last post by admin « Wed Jan 30, 2013 4:12 pm
Replies: 1
by asaivenk » Tue Jan 22, 2013 6:52 am

1 Replies

2768 Views

Last post by admin
Wed Jan 30, 2013 4:12 pm
weird ordering of band-energies

Last post by admin « Wed Jan 30, 2013 4:09 pm
Replies: 1
by magnon963 » Wed Jan 23, 2013 3:08 pm

1 Replies

4142 Views

Last post by admin
Wed Jan 30, 2013 4:09 pm
AECCAR0 content?

Last post by admin « Wed Jan 30, 2013 11:15 am
Replies: 1
by yargk » Tue Jan 29, 2013 7:24 am

1 Replies

2379 Views

Last post by admin
Wed Jan 30, 2013 11:15 am
setting orbital occupancy matrix

Last post by kamalch « Wed Jan 30, 2013 3:26 am
Replies: 2
by ajsmth » Thu May 03, 2012 4:21 pm

2 Replies

4746 Views

Last post by kamalch
Wed Jan 30, 2013 3:26 am
PROCAR - d orbitals

Last post by admin « Mon Jan 28, 2013 3:33 pm
Replies: 1
by zrfssh » Sat Jan 26, 2013 6:55 pm

1 Replies

3113 Views

Last post by admin
Mon Jan 28, 2013 3:33 pm
External Electric Field in VASP

Last post by zhangjinmt « Fri Jan 25, 2013 11:58 am
Replies: 6
by Eugene » Tue Apr 12, 2005 1:48 am

6 Replies

16760 Views

Last post by zhangjinmt
Fri Jan 25, 2013 11:58 am
Question about EFIELD in VASP

Last post by zhangjinmt « Fri Jan 25, 2013 11:57 am
Replies: 2
by zhangjinmt » Fri Jan 25, 2013 8:32 am

2 Replies

2998 Views

Last post by zhangjinmt
Fri Jan 25, 2013 11:57 am
All atoms are shifted...

Last post by admin « Thu Jan 24, 2013 3:44 pm
Replies: 3
by danith » Tue Jan 22, 2013 4:52 pm

3 Replies

3298 Views

Last post by admin
Thu Jan 24, 2013 3:44 pm
Q about E-fermi and alpha+bet

Last post by WolverBean « Wed Jan 23, 2013 8:16 pm
Replies: 4
by des » Sun Aug 13, 2006 9:09 pm

4 Replies

13161 Views

Last post by WolverBean
Wed Jan 23, 2013 8:16 pm
potentials for copper

Last post by admin « Wed Jan 23, 2013 4:45 pm
Replies: 1
by priyagoud » Wed Jan 23, 2013 6:35 am

1 Replies

2737 Views

Last post by admin
Wed Jan 23, 2013 4:45 pm
Partial dos

Last post by jyoti « Wed Jan 23, 2013 9:12 am
Replies: 2
by jyoti » Mon Jan 21, 2013 8:08 am

2 Replies

2976 Views

Last post by jyoti
Wed Jan 23, 2013 9:12 am
how to analyze point group symmetry of a specific KS orbital from WAVECAR?

Last post by maartendft « Thu Jan 17, 2013 8:18 pm
Replies: 2
by bsmile » Tue Jan 15, 2013 7:21 pm

2 Replies

3273 Views

Last post by maartendft
Thu Jan 17, 2013 8:18 pm
how to make the DOS line smooth

Last post by maartendft « Thu Jan 17, 2013 8:15 pm
Replies: 1
by arnt » Thu Jan 10, 2013 8:54 pm

1 Replies

3352 Views

Last post by maartendft
Thu Jan 17, 2013 8:15 pm
POSCAR file for Copper 211 surface

Last post by cappri « Mon Jan 14, 2013 6:18 pm
Replies: 1
by cappri » Mon Jan 14, 2013 5:23 pm

1 Replies

3222 Views

Last post by cappri
Mon Jan 14, 2013 6:18 pm
GADGET optimization in internal coordinates in vasp 5?

Last post by cpp6f « Fri Jan 11, 2013 7:33 pm
Replies: 2
by cpp6f » Thu Jan 10, 2013 5:35 am

2 Replies

3179 Views

Last post by cpp6f
Fri Jan 11, 2013 7:33 pm
What is AECCAR2?

Last post by yargk « Fri Jan 11, 2013 8:00 am
Replies: 2
by yargk » Thu Jan 03, 2013 8:05 pm

2 Replies

5650 Views

Last post by yargk
Fri Jan 11, 2013 8:00 am
Adatom on/in my surface...

Last post by blazing « Tue Jan 08, 2013 5:05 pm
Replies: 1
by danith » Sun Jan 06, 2013 2:47 pm

1 Replies

2483 Views

Last post by blazing
Tue Jan 08, 2013 5:05 pm
Relaxation of 2D materials!

Last post by danith « Mon Jan 07, 2013 12:10 pm
Replies: 2
by hosfa » Fri Dec 21, 2012 12:36 pm

2 Replies

4023 Views

Last post by danith
Mon Jan 07, 2013 12:10 pm

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