GW calculations

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Yambo school 2025 in Modena, Italy

by Daniele Varsano » Fri Feb 14, 2025 8:37 am
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README first

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convergence behaviour with XTermKind

by Christian Koenig » Mon Mar 02, 2020 11:30 am
Last post by Christian Koenig » Mon Mar 09, 2020 11:40 am
Replies: 11
by Christian Koenig » Mon Mar 02, 2020 11:30 am
1

2
Replies: 11
Views: 6025

Last post by Christian Koenig
Mon Mar 09, 2020 11:40 am
Multiple output file for HF calculation

by el16yz » Thu Feb 06, 2020 12:10 pm
Last post by Daniele Varsano » Fri Feb 07, 2020 3:27 pm
Replies: 3
by el16yz » Thu Feb 06, 2020 12:10 pm

Replies: 3
Views: 2161

Last post by Daniele Varsano
Fri Feb 07, 2020 3:27 pm
Degeneracy breakdown

by javad » Thu Feb 06, 2020 10:33 am
Last post by claudio » Thu Feb 06, 2020 3:29 pm
Replies: 1
by javad » Thu Feb 06, 2020 10:33 am

Replies: 1
Views: 2064

Last post by claudio
Thu Feb 06, 2020 3:29 pm
Visualizing Molecular Orbitals obtained from COHSEX

by rvatanme » Thu Jul 23, 2015 6:12 pm
Last post by aseemrajan » Fri Jan 31, 2020 11:18 am
Replies: 9
by rvatanme » Thu Jul 23, 2015 6:12 pm

Replies: 9
Views: 7271

Last post by aseemrajan
Fri Jan 31, 2020 11:18 am
NaN E-E0 result for Mg

by burkzdemir » Thu Dec 12, 2019 10:34 am
Last post by Daniele Varsano » Fri Jan 10, 2020 11:47 am
Replies: 18
by burkzdemir » Thu Dec 12, 2019 10:34 am
1

2
Replies: 18
Views: 8536

Last post by Daniele Varsano
Fri Jan 10, 2020 11:47 am
G0W0 Calculation using Truncated Coulomb Potential

by Bapan » Mon Nov 18, 2019 4:46 pm
Last post by Daniele Varsano » Thu Nov 28, 2019 9:39 am
Replies: 19
by Bapan » Mon Nov 18, 2019 4:46 pm
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2
Replies: 19
Views: 8803

Last post by Daniele Varsano
Thu Nov 28, 2019 9:39 am
plasmon-pole approximation and Hartree Fock convergence

by Christian Koenig » Mon Nov 18, 2019 1:32 pm
Last post by Daniele Varsano » Mon Nov 18, 2019 4:10 pm
Replies: 3
by Christian Koenig » Mon Nov 18, 2019 1:32 pm

Replies: 3
Views: 2442

Last post by Daniele Varsano
Mon Nov 18, 2019 4:10 pm
Error during running Hartree-Fock example for h-BN

by soumyadeepghosh35 » Thu Nov 07, 2019 10:05 am
Last post by soumyadeepghosh35 » Thu Nov 07, 2019 1:13 pm
Replies: 8
by soumyadeepghosh35 » Thu Nov 07, 2019 10:05 am

Replies: 8
Views: 3929

Last post by soumyadeepghosh35
Thu Nov 07, 2019 1:13 pm
Error in run HF calculation

by el16yz » Fri Oct 25, 2019 11:17 am
Last post by el16yz » Tue Oct 29, 2019 11:13 am
Replies: 4
by el16yz » Fri Oct 25, 2019 11:17 am

Replies: 4
Views: 3109

Last post by el16yz
Tue Oct 29, 2019 11:13 am
oscillatory hydock

by burkzdemir » Mon Feb 25, 2019 5:41 pm
Last post by Daniele Varsano » Sun Sep 08, 2019 10:05 am
Replies: 3
by burkzdemir » Mon Feb 25, 2019 5:41 pm

Replies: 3
Views: 2498

Last post by Daniele Varsano
Sun Sep 08, 2019 10:05 am
Quasiparticle (GW) or BSE spectrum for anisotropic crystal

by cantele » Thu Jan 28, 2010 10:32 pm
Last post by nayam » Thu Aug 29, 2019 5:49 am
Replies: 4
by cantele » Thu Jan 28, 2010 10:32 pm

Replies: 4
Views: 5483

Last post by nayam
Thu Aug 29, 2019 5:49 am
stop with dp running

by sdwang » Sun Jul 14, 2019 2:48 am
Last post by andrea.ferretti » Mon Jul 15, 2019 10:06 pm
Replies: 1
by sdwang » Sun Jul 14, 2019 2:48 am

Replies: 1
Views: 1348

Last post by andrea.ferretti
Mon Jul 15, 2019 10:06 pm
Error in calculating sigma

by sdwang » Sat Jul 13, 2019 2:34 pm
Last post by sdwang » Mon Jul 15, 2019 1:10 pm
Replies: 4
by sdwang » Sat Jul 13, 2019 2:34 pm

Replies: 4
Views: 2270

Last post by sdwang
Mon Jul 15, 2019 1:10 pm
Band gap error for monolayer MoS2

by Tianshu » Mon May 27, 2019 2:38 am
Last post by Daniele Varsano » Wed Jun 05, 2019 8:18 am
Replies: 2
by Tianshu » Mon May 27, 2019 2:38 am

Replies: 2
Views: 2055

Last post by Daniele Varsano
Wed Jun 05, 2019 8:18 am
GW band gap same with PBE

by burkzdemir » Sat May 25, 2019 11:35 am
Last post by Daniele Varsano » Mon May 27, 2019 1:24 pm
Replies: 10
by burkzdemir » Sat May 25, 2019 11:35 am
1

2
Replies: 10
Views: 5177

Last post by Daniele Varsano
Mon May 27, 2019 1:24 pm
negative self-energy

by Weiqing Zhou » Mon May 20, 2019 1:58 pm
Last post by andrea.ferretti » Thu May 23, 2019 10:10 am
Replies: 5
by Weiqing Zhou » Mon May 20, 2019 1:58 pm

Replies: 5
Views: 2800

Last post by andrea.ferretti
Thu May 23, 2019 10:10 am
temperature in GW calculation

by Weiqing Zhou » Mon Oct 15, 2018 2:57 am
Last post by Daniele Varsano » Mon Apr 08, 2019 10:46 am
Replies: 7
by Weiqing Zhou » Mon Oct 15, 2018 2:57 am

Replies: 7
Views: 4007

Last post by Daniele Varsano
Mon Apr 08, 2019 10:46 am
GDamping and DmRngeXd

by Weiqing Zhou » Thu Apr 04, 2019 10:05 am
Last post by Daniele Varsano » Thu Apr 04, 2019 1:11 pm
Replies: 1
by Weiqing Zhou » Thu Apr 04, 2019 10:05 am

Replies: 1
Views: 1507

Last post by Daniele Varsano
Thu Apr 04, 2019 1:11 pm
quasiparticle lifetime

by Weiqing Zhou » Thu Nov 08, 2018 4:46 am
Last post by Daniele Varsano » Mon Jan 21, 2019 10:02 am
Replies: 7
by Weiqing Zhou » Thu Nov 08, 2018 4:46 am

Replies: 7
Views: 3643

Last post by Daniele Varsano
Mon Jan 21, 2019 10:02 am
Some query in updated yambo 4.3.0

by sitangshu » Thu Jan 17, 2019 1:45 pm
Last post by Davide Sangalli » Fri Jan 18, 2019 5:11 pm
Replies: 5
by sitangshu » Thu Jan 17, 2019 1:45 pm

Replies: 5
Views: 2738

Last post by Davide Sangalli
Fri Jan 18, 2019 5:11 pm
[ERROR] [Atoms] incomplete mapping found.

by sdwang » Mon Oct 29, 2018 4:07 pm
Last post by xianzhong » Sat Jan 05, 2019 1:06 pm
Replies: 3
by sdwang » Mon Oct 29, 2018 4:07 pm

Replies: 3
Views: 2264

Last post by xianzhong
Sat Jan 05, 2019 1:06 pm
gap's problem

by fatimazahra » Mon Jun 15, 2015 11:13 am
Last post by Daniele Varsano » Thu Nov 15, 2018 10:15 am
Replies: 11
by fatimazahra » Mon Jun 15, 2015 11:13 am
1

2
Replies: 11
Views: 9490

Last post by Daniele Varsano
Thu Nov 15, 2018 10:15 am
green function energy range GEnRnge

by Weiqing Zhou » Wed Oct 24, 2018 4:45 am
Last post by Daniele Varsano » Wed Oct 24, 2018 9:33 am
Replies: 1
by Weiqing Zhou » Wed Oct 24, 2018 4:45 am

Replies: 1
Views: 1649

Last post by Daniele Varsano
Wed Oct 24, 2018 9:33 am
gw calculation on 0D sysmem

by ljzhou86 » Sun Sep 23, 2018 11:31 am
Last post by Daniele Varsano » Thu Oct 18, 2018 9:32 am
Replies: 5
by ljzhou86 » Sun Sep 23, 2018 11:31 am

Replies: 5
Views: 2771

Last post by Daniele Varsano
Thu Oct 18, 2018 9:32 am
the imaginary part of Green function along chosen k-path

by Weiqing Zhou » Mon Oct 15, 2018 3:31 am
Last post by Daniele Varsano » Mon Oct 15, 2018 8:02 am
Replies: 1
by Weiqing Zhou » Mon Oct 15, 2018 3:31 am

Replies: 1
Views: 1598

Last post by Daniele Varsano
Mon Oct 15, 2018 8:02 am

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