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GW+BSE Calculations

Last post by gbal « Thu Jan 18, 2018 3:16 pm
Replies: 5
by dscullion12 » Mon May 15, 2017 10:09 am

5 Replies

11195 Views

Last post by gbal
Thu Jan 18, 2018 3:16 pm
DFT+vdWsurf implementation

Last post by admin « Fri Jan 12, 2018 1:08 pm
Replies: 2
by agtonner » Fri Dec 22, 2017 1:22 pm

2 Replies

7557 Views

Last post by admin
Fri Jan 12, 2018 1:08 pm
LCALCEPS, IVDW, TOTAL ENERGY, and BORN EFFECTIVE CHARGES

Last post by ido « Tue Oct 31, 2017 5:38 am
Replies: 2
by ido » Wed Oct 25, 2017 6:58 am

2 Replies

6106 Views

Last post by ido
Tue Oct 31, 2017 5:38 am
Error in TS\IH dispersion correction calculations

Last post by admin « Tue Oct 17, 2017 11:51 am
Replies: 3
by scadars » Tue Oct 10, 2017 11:01 am

3 Replies

7819 Views

Last post by admin
Tue Oct 17, 2017 11:51 am
too slow Hirshfeld charges in iterative Tkatchenko-Scheffler

Last post by scadars « Tue Oct 10, 2017 11:20 am
Replies: 2
by jcconesa » Mon Dec 05, 2016 8:52 pm

2 Replies

7742 Views

Last post by scadars
Tue Oct 10, 2017 11:20 am
ERROR in subspace rotation PSSYEVX: not enough eigenvalues f

Last post by admin « Tue Sep 26, 2017 12:25 pm
Replies: 1
by mdhossain » Mon Sep 11, 2017 12:15 pm

1 Replies

15321 Views

Last post by admin
Tue Sep 26, 2017 12:25 pm
There is a puzzling problem in applying esternal field

Last post by yjwang « Mon Jul 10, 2017 3:18 am
Replies: 2
by yjwang » Tue Jul 04, 2017 9:23 am

2 Replies

5400 Views

Last post by yjwang
Mon Jul 10, 2017 3:18 am
How to completely avoid "aliasing errors"?

Last post by byin « Fri Jun 02, 2017 1:23 pm
Replies: 2
by byin » Tue May 09, 2017 4:08 pm

2 Replies

6964 Views

Last post by byin
Fri Jun 02, 2017 1:23 pm
Memory leak in GPU build?

Last post by hushujun « Thu Apr 27, 2017 5:20 am
Replies: 1
by tfrankcombe » Wed Mar 08, 2017 11:57 pm

1 Replies

5217 Views

Last post by hushujun
Thu Apr 27, 2017 5:20 am
Memory usage by VASP-5.4 DFPT calculations

Last post by alex « Thu Apr 13, 2017 9:34 am
Replies: 3
by deepashri » Sat Apr 08, 2017 6:18 am

3 Replies

7755 Views

Last post by alex
Thu Apr 13, 2017 9:34 am
Abnormal Termination

Last post by admin « Fri Mar 17, 2017 10:41 am
Replies: 3
by ganguly » Tue Mar 07, 2017 7:19 am

3 Replies

7363 Views

Last post by admin
Fri Mar 17, 2017 10:41 am
TDHF: unexpected output parameters in OUTCAR

Last post by ashwin « Wed Mar 15, 2017 3:31 pm
Replies: 2
by ashwin » Thu Mar 09, 2017 10:13 pm

2 Replies

5997 Views

Last post by ashwin
Wed Mar 15, 2017 3:31 pm
Bug: eigenvectors of non mass-weighted Hessian matrix

Last post by rgarcia « Tue Mar 07, 2017 3:27 pm
Replies: 6
by rgarcia » Fri Nov 25, 2016 3:41 pm

6 Replies

11930 Views

Last post by rgarcia
Tue Mar 07, 2017 3:27 pm
Error in calculating the Optical Properties for 1D system

Last post by admin « Thu Feb 02, 2017 12:05 pm
Replies: 3
by jjhskang » Wed Nov 16, 2016 8:56 am

3 Replies

8557 Views

Last post by admin
Thu Feb 02, 2017 12:05 pm
Error in documentation about SAXIS

Last post by admin « Fri Jan 13, 2017 2:50 pm
Replies: 1
by qiaojunfeng » Fri Dec 16, 2016 5:38 am

1 Replies

4343 Views

Last post by admin
Fri Jan 13, 2017 2:50 pm
Clarification on potpaw_PBE versions

Last post by admin « Mon Dec 12, 2016 3:55 pm
Replies: 1
by MelissaH » Sat Dec 10, 2016 6:52 pm

1 Replies

7242 Views

Last post by admin
Mon Dec 12, 2016 3:55 pm
Segmentation fault GW

Last post by admin « Thu Nov 17, 2016 11:45 am
Replies: 1
by alexshipilova » Mon Nov 07, 2016 12:43 pm

1 Replies

4919 Views

Last post by admin
Thu Nov 17, 2016 11:45 am
NBANDSGWLOW problem

Last post by ntuxi « Mon Nov 07, 2016 7:37 am
Replies: 2
by ntuxi » Wed Oct 26, 2016 8:04 am

2 Replies

5437 Views

Last post by ntuxi
Mon Nov 07, 2016 7:37 am
Parallelization/MPI problem on Cray XC30/40 (hangs)

Last post by ahampel « Wed Oct 26, 2016 9:49 am
Replies: 2
by ahampel » Wed Feb 24, 2016 4:36 pm

2 Replies

6875 Views

Last post by ahampel
Wed Oct 26, 2016 9:49 am
Random performance lost

Last post by fish « Thu Oct 06, 2016 5:18 pm
Replies: 1
by jun » Mon Jun 27, 2016 2:48 am

1 Replies

4512 Views

Last post by fish
Thu Oct 06, 2016 5:18 pm

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