Using VASP

Moderators: Global Moderator, Moderator

New Topic

5577 topics

Page 42 of 279
- Jump to page:
Previous
1
…
40
41
42
43
44
…
279
Next

Topics

Replies

Views

Last post

Rotational temperature

Last post by support_vasp « Thu Sep 12, 2024 7:35 am
Replies: 1
by siddarth1753 » Tue Sep 03, 2013 6:47 pm

1 Replies

2402 Views

Last post by support_vasp
Thu Sep 12, 2024 7:35 am
Problem about calculating CO adsorption

Last post by support_vasp « Thu Sep 12, 2024 7:35 am
Replies: 1
by feng_gao » Tue Sep 03, 2013 9:59 pm

1 Replies

2551 Views

Last post by support_vasp
Thu Sep 12, 2024 7:35 am
How to calculate the Inelastic Electron Tunneling Spectroscopy (IETS) in VASP

Last post by support_vasp « Thu Sep 12, 2024 7:35 am
Replies: 1
by rockhardway » Wed Sep 04, 2013 9:24 am

1 Replies

2368 Views

Last post by support_vasp
Thu Sep 12, 2024 7:35 am
Formation Energy of Cr2O3

Last post by support_vasp « Thu Sep 12, 2024 7:34 am
Replies: 1
by superyoyo » Sat Nov 12, 2011 11:48 am

1 Replies

3311 Views

Last post by support_vasp
Thu Sep 12, 2024 7:34 am
metagga M06L problem

Last post by support_vasp « Thu Sep 12, 2024 7:34 am
Replies: 1
by hundred » Thu Apr 19, 2012 3:25 pm

1 Replies

3216 Views

Last post by support_vasp
Thu Sep 12, 2024 7:34 am
What magnetization(x) will give in OUTCAR file. Is it total magnetic moment?

Last post by support_vasp « Thu Sep 12, 2024 7:34 am
Replies: 1
by sunny » Thu Sep 20, 2012 12:35 pm

1 Replies

2832 Views

Last post by support_vasp
Thu Sep 12, 2024 7:34 am
How to set DIPOL?

Last post by support_vasp « Thu Sep 12, 2024 7:34 am
Replies: 1
by fanzhen » Sat Nov 12, 2011 3:28 pm

1 Replies

2875 Views

Last post by support_vasp
Thu Sep 12, 2024 7:34 am
different electric field has same results

Last post by support_vasp « Thu Sep 12, 2024 7:34 am
Replies: 1
by zhu » Sat Jun 14, 2014 5:36 pm

1 Replies

2800 Views

Last post by support_vasp
Thu Sep 12, 2024 7:34 am
errors in calculation of electron localization function(ELFCAR)

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by bighunter » Sat Jun 14, 2014 6:44 am

1 Replies

2880 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
How to choose the POTCAR for mBJ calculation?

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by hol28 » Fri Jun 13, 2014 8:37 am

1 Replies

2889 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
Recipe for effective masses calculations

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by hat » Thu Jun 12, 2014 2:02 pm

1 Replies

2780 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
augmentation occupancy

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by freshwind » Mon Aug 05, 2013 3:53 pm

1 Replies

2906 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
Dispersion Coefficient

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by mahmud » Wed Nov 14, 2012 5:47 pm

1 Replies

2436 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
printing out partial magnetization in spin-polarized hybrid calc

Last post by support_vasp « Thu Sep 12, 2024 7:33 am
Replies: 1
by md » Thu Nov 10, 2011 3:50 pm

1 Replies

2872 Views

Last post by support_vasp
Thu Sep 12, 2024 7:33 am
MD for icosahedron

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by M Dave » Mon Jan 21, 2013 2:35 pm

1 Replies

2470 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
DFT+U

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by SKS » Sun Aug 04, 2013 5:35 pm

1 Replies

2593 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Cell optimization and atomic relaxation

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by Lian » Thu Apr 25, 2013 3:29 pm

1 Replies

2719 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
L(S)DA Pseudopotential

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by assari10 » Mon Mar 05, 2012 10:03 am

1 Replies

2595 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
How to print out the kinetic energy of system in a total energy calculations by VASP.

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by sfli » Thu Nov 10, 2011 6:58 pm

1 Replies

3084 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am
Convergence problems with EFIELD and NELECT

Last post by support_vasp « Thu Sep 12, 2024 7:32 am
Replies: 1
by emera86 » Tue Jul 31, 2012 12:34 pm

1 Replies

3450 Views

Last post by support_vasp
Thu Sep 12, 2024 7:32 am

New Topic

5577 topics

Page 42 of 279
- Jump to page:
Previous
1
…
40
41
42
43
44
…
279
Next

Return to Board Index

Forum permissions

You cannot post new topics in this forum
You cannot reply to topics in this forum
You cannot edit your posts in this forum
You cannot delete your posts in this forum
You cannot post attachments in this forum