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

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Views: 85816

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

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GW calculation error

by Akash » Sun Oct 01, 2023 2:13 pm
Replies: 0
by Akash » Sun Oct 01, 2023 2:13 pm

Replies: 0
Views: 4

Last post by Akash
Sun Oct 01, 2023 2:13 pm
How to generate BSE basis in the EPC luminescence

by jasonhan0710 » Sun Oct 01, 2023 10:50 am
Replies: 0
by jasonhan0710 » Sun Oct 01, 2023 10:50 am

Replies: 0
Views: 5

Last post by jasonhan0710
Sun Oct 01, 2023 10:50 am
Empty Screening input file

by KinawyM » Sun Oct 01, 2023 9:41 am
Replies: 0
by KinawyM » Sun Oct 01, 2023 9:41 am

Replies: 0
Views: 11

Last post by KinawyM
Sun Oct 01, 2023 9:41 am
GW QP Bandgap

by Jagjit Kaur » Sat Sep 30, 2023 9:17 am
Replies: 0
by Jagjit Kaur » Sat Sep 30, 2023 9:17 am

Replies: 0
Views: 11

Last post by Jagjit Kaur
Sat Sep 30, 2023 9:17 am
evGW

by sdwang » Tue Sep 26, 2023 1:46 am
Last post by Daniele Varsano » Tue Sep 26, 2023 10:25 am
Replies: 1
by sdwang » Tue Sep 26, 2023 1:46 am

Replies: 1
Views: 22

Last post by Daniele Varsano
Tue Sep 26, 2023 10:25 am
GW calculation terminating without any error

by Akash » Sun Sep 03, 2023 7:05 am
Last post by Akash » Tue Sep 26, 2023 6:26 am
Replies: 2
by Akash » Sun Sep 03, 2023 7:05 am

Replies: 2
Views: 51

Last post by Akash
Tue Sep 26, 2023 6:26 am
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: 93

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: 66

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: 24

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: 62

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: 27

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: 125

Last post by Gao Siyuan
Sat Sep 09, 2023 7:17 am
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: 55

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: 26

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: 132

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: 70

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: 192

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: 119

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: 75

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: 137

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: 72

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: 116

Last post by baiyunfei
Mon May 08, 2023 10:19 am

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