GW calculations

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README first

by andrea marini » Wed Apr 08, 2009 9:05 am
Posted in Compilation
Replies: 0
by andrea marini » Wed Apr 08, 2009 9:05 am » in Compilation

Replies: 0
Views: 85805

Last post by andrea marini
Wed Apr 08, 2009 9:05 am

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GW PPA termination with no error

by shobhit21287 » Thu Aug 10, 2023 7:45 pm
Last post by Daniele Varsano » Fri Sep 22, 2023 5:15 pm
Replies: 7
by shobhit21287 » Thu Aug 10, 2023 7:45 pm

Replies: 7
Views: 75

Last post by Daniele Varsano
Fri Sep 22, 2023 5:15 pm
BSE and exciton analysis

by manaswitakar » Tue Sep 12, 2023 1:14 pm
Last post by manaswitakar » Thu Sep 21, 2023 11:33 am
Replies: 8
by manaswitakar » Tue Sep 12, 2023 1:14 pm

Replies: 8
Views: 52

Last post by manaswitakar
Thu Sep 21, 2023 11:33 am
PBE0 forYambo

by sdwang » Sun Sep 17, 2023 8:14 am
Last post by Daniele Varsano » Mon Sep 18, 2023 8:50 am
Replies: 1
by sdwang » Sun Sep 17, 2023 8:14 am

Replies: 1
Views: 18

Last post by Daniele Varsano
Mon Sep 18, 2023 8:50 am
BSE, QP interpolation from a coarser grid

by ff10 » Sat Sep 09, 2023 4:19 pm
Last post by claudio » Fri Sep 15, 2023 11:35 am
Replies: 5
by ff10 » Sat Sep 09, 2023 4:19 pm

Replies: 5
Views: 49

Last post by claudio
Fri Sep 15, 2023 11:35 am
BSE kernel

by dmachiri » Tue Sep 05, 2023 9:38 am
Last post by Daniele Varsano » Mon Sep 11, 2023 11:10 am
Replies: 2
by dmachiri » Tue Sep 05, 2023 9:38 am

Replies: 2
Views: 36

Last post by Daniele Varsano
Mon Sep 11, 2023 11:10 am
negative real part of 2D macroscopic polarizability

by lldu » Mon Sep 04, 2023 10:18 am
Last post by Daniele Varsano » Mon Sep 11, 2023 11:05 am
Replies: 1
by lldu » Mon Sep 04, 2023 10:18 am

Replies: 1
Views: 26

Last post by Daniele Varsano
Mon Sep 11, 2023 11:05 am
NaN in quasiparticle energies calculation with yambo-5.1.2

by Gao Siyuan » Fri Sep 01, 2023 4:45 am
Last post by Gao Siyuan » Sat Sep 09, 2023 7:17 am
Replies: 5
by Gao Siyuan » Fri Sep 01, 2023 4:45 am

Replies: 5
Views: 109

Last post by Gao Siyuan
Sat Sep 09, 2023 7:17 am
GW calculation terminating without any error

by Akash » Sun Sep 03, 2023 7:05 am
Last post by Daniele Varsano » Thu Sep 07, 2023 5:36 pm
Replies: 1
by Akash » Sun Sep 03, 2023 7:05 am

Replies: 1
Views: 34

Last post by Daniele Varsano
Thu Sep 07, 2023 5:36 pm
NaN of quasiparticle energies with v-5.2.0

by sdwang » Thu Aug 03, 2023 4:37 am
Last post by Daniele Varsano » Mon Aug 28, 2023 10:03 am
Replies: 3
by sdwang » Thu Aug 03, 2023 4:37 am

Replies: 3
Views: 50

Last post by Daniele Varsano
Mon Aug 28, 2023 10:03 am
GW input file generation error

by joydev.de » Mon Aug 21, 2023 9:23 pm
Last post by Daniele Varsano » Fri Aug 25, 2023 9:52 am
Replies: 1
by joydev.de » Mon Aug 21, 2023 9:23 pm

Replies: 1
Views: 24

Last post by Daniele Varsano
Fri Aug 25, 2023 9:52 am
GW+ELPH+HF in YAMBO 5.1

by LHuang » Sun Jul 02, 2023 7:42 pm
Last post by claudio » Fri Aug 25, 2023 8:44 am
Replies: 9
by LHuang » Sun Jul 02, 2023 7:42 pm

Replies: 9
Views: 125

Last post by claudio
Fri Aug 25, 2023 8:44 am
Crash when running GW for a large system

by stefan19rkc » Thu Jun 29, 2023 10:22 am
Last post by Daniele Varsano » Thu Jun 29, 2023 4:31 pm
Replies: 2
by stefan19rkc » Thu Jun 29, 2023 10:22 am

Replies: 2
Views: 65

Last post by Daniele Varsano
Thu Jun 29, 2023 4:31 pm
The gap breaks down after GW approximation

by y.mostafa » Mon Jun 19, 2023 10:24 am
Last post by y.mostafa » Sat Jun 24, 2023 11:33 am
Replies: 7
by y.mostafa » Mon Jun 19, 2023 10:24 am

Replies: 7
Views: 189

Last post by y.mostafa
Sat Jun 24, 2023 11:33 am
Self-consistent GW on eigenvalues only

by engelund » Wed Jun 14, 2023 3:38 pm
Last post by engelund » Tue Jun 20, 2023 5:04 pm
Replies: 6
by engelund » Wed Jun 14, 2023 3:38 pm

Replies: 6
Views: 132

Last post by engelund
Tue Jun 20, 2023 5:04 pm
Extract BS kernel information

by pangrt » Mon Jun 19, 2023 3:52 am
Last post by Daniele Varsano » Tue Jun 20, 2023 1:12 pm
Replies: 3
by pangrt » Mon Jun 19, 2023 3:52 am

Replies: 3
Views: 114

Last post by Daniele Varsano
Tue Jun 20, 2023 1:12 pm
Structure of QP_table

by Franz Fischer » Tue Jun 13, 2023 2:47 pm
Last post by Franz Fischer » Tue Jun 13, 2023 7:33 pm
Replies: 2
by Franz Fischer » Tue Jun 13, 2023 2:47 pm

Replies: 2
Views: 74

Last post by Franz Fischer
Tue Jun 13, 2023 7:33 pm
G0W0@PBE or G0W0@HSE06

by emarinho » Sun Jun 11, 2023 3:38 am
Last post by Daniele Varsano » Mon Jun 12, 2023 8:49 am
Replies: 1
by emarinho » Sun Jun 11, 2023 3:38 am

Replies: 1
Views: 123

Last post by Daniele Varsano
Mon Jun 12, 2023 8:49 am
keyword issues

by manaswitakar » Tue Jun 06, 2023 10:06 am
Last post by Daniele Varsano » Tue Jun 06, 2023 10:15 am
Replies: 1
by manaswitakar » Tue Jun 06, 2023 10:06 am

Replies: 1
Views: 69

Last post by Daniele Varsano
Tue Jun 06, 2023 10:15 am
problems in dipole calculation using covariant method

by baiyunfei » Fri May 19, 2023 2:00 am
Last post by Daniele Varsano » Tue May 30, 2023 8:02 am
Replies: 5
by baiyunfei » Fri May 19, 2023 2:00 am

Replies: 5
Views: 140

Last post by Daniele Varsano
Tue May 30, 2023 8:02 am
Some question about ndb.dipole in yambo

by baiyunfei » Sun May 07, 2023 10:29 am
Last post by baiyunfei » Mon May 08, 2023 10:19 am
Replies: 2
by baiyunfei » Sun May 07, 2023 10:29 am

Replies: 2
Views: 114

Last post by baiyunfei
Mon May 08, 2023 10:19 am
GW and BSE calculations with larger k-point mesh

by nileshkumar » Thu May 04, 2023 3:29 pm
Last post by Daniele Varsano » Mon May 08, 2023 8:37 am
Replies: 3
by nileshkumar » Thu May 04, 2023 3:29 pm

Replies: 3
Views: 125

Last post by Daniele Varsano
Mon May 08, 2023 8:37 am
G0W0+PPA Terminator Behavior

by AzulineSky » Tue Apr 25, 2023 3:00 pm
Last post by Daniele Varsano » Fri Apr 28, 2023 8:52 am
Replies: 2
by AzulineSky » Tue Apr 25, 2023 3:00 pm

Replies: 2
Views: 106

Last post by Daniele Varsano
Fri Apr 28, 2023 8:52 am
query about band reordering

by Dean » Wed Apr 19, 2023 3:41 am
Last post by Daniele Varsano » Fri Apr 28, 2023 8:27 am
Replies: 3
by Dean » Wed Apr 19, 2023 3:41 am

Replies: 3
Views: 130

Last post by Daniele Varsano
Fri Apr 28, 2023 8:27 am
low efficency of GPU version

by Dean » Mon Apr 24, 2023 11:10 am
Last post by Dean » Wed Apr 26, 2023 11:37 am
Replies: 2
by Dean » Mon Apr 24, 2023 11:10 am

Replies: 2
Views: 92

Last post by Dean
Wed Apr 26, 2023 11:37 am
interpolate static screen

by baiyunfei » Thu Mar 30, 2023 3:14 pm
Last post by Daniele Varsano » Mon Apr 03, 2023 10:08 am
Replies: 1
by baiyunfei » Thu Mar 30, 2023 3:14 pm

Replies: 1
Views: 95

Last post by Daniele Varsano
Mon Apr 03, 2023 10:08 am

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