GW calculations

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question about HF exchange correction

by rvatanme » Sat Jun 27, 2015 1:20 am
Last post by rvatanme » Sat Jul 04, 2015 8:27 pm
Replies: 4
by rvatanme » Sat Jun 27, 2015 1:20 am

Replies: 4
Views: 4172

Last post by rvatanme
Sat Jul 04, 2015 8:27 pm
Convergence parameters for lifetimes

by Andy » Thu Jun 25, 2015 2:07 pm
Replies: 0
by Andy » Thu Jun 25, 2015 2:07 pm

Replies: 0
Views: 1621

Last post by Andy
Thu Jun 25, 2015 2:07 pm
Self-consistent GW

by marsoner » Wed Jun 24, 2015 12:25 pm
Last post by marsoner » Wed Jun 24, 2015 2:07 pm
Replies: 2
by marsoner » Wed Jun 24, 2015 12:25 pm

Replies: 2
Views: 2654

Last post by marsoner
Wed Jun 24, 2015 2:07 pm
problems with bse

by samaneh » Tue Jun 23, 2015 9:46 am
Last post by Daniele Varsano » Tue Jun 23, 2015 2:04 pm
Replies: 1
by samaneh » Tue Jun 23, 2015 9:46 am

Replies: 1
Views: 2229

Last post by Daniele Varsano
Tue Jun 23, 2015 2:04 pm
GW0 calculations

by amolina » Tue Dec 16, 2014 12:49 pm
Last post by Daniele Varsano » Wed Jun 17, 2015 9:02 am
Replies: 3
by amolina » Tue Dec 16, 2014 12:49 pm

Replies: 3
Views: 3835

Last post by Daniele Varsano
Wed Jun 17, 2015 9:02 am
static remainder method

by samaneh » Mon Jun 15, 2015 8:24 am
Last post by Daniele Varsano » Mon Jun 15, 2015 10:32 am
Replies: 5
by samaneh » Mon Jun 15, 2015 8:24 am

Replies: 5
Views: 5511

Last post by Daniele Varsano
Mon Jun 15, 2015 10:32 am
Is the correction for occupation important?

by zsjan » Mon May 18, 2015 8:49 am
Last post by Daniele Varsano » Mon May 18, 2015 10:12 am
Replies: 3
by zsjan » Mon May 18, 2015 8:49 am

Replies: 3
Views: 2745

Last post by Daniele Varsano
Mon May 18, 2015 10:12 am
Error running parallel calculations with Coulomb cutoff

by ldx03 » Sun May 10, 2015 8:58 pm
Last post by Daniele Varsano » Tue May 12, 2015 5:47 pm
Replies: 9
by ldx03 » Sun May 10, 2015 8:58 pm

Replies: 9
Views: 4591

Last post by Daniele Varsano
Tue May 12, 2015 5:47 pm
PPA suitability

by asanchez » Fri May 08, 2015 12:52 pm
Last post by Daniele Varsano » Fri May 08, 2015 1:38 pm
Replies: 1
by asanchez » Fri May 08, 2015 12:52 pm

Replies: 1
Views: 2208

Last post by Daniele Varsano
Fri May 08, 2015 1:38 pm
total energy

by samaneh » Fri May 08, 2015 7:17 am
Last post by Daniele Varsano » Fri May 08, 2015 8:11 am
Replies: 1
by samaneh » Fri May 08, 2015 7:17 am

Replies: 1
Views: 1400

Last post by Daniele Varsano
Fri May 08, 2015 8:11 am
error during lifetime calculation

by Andy » Tue Apr 28, 2015 1:09 pm
Last post by Andy » Tue Apr 28, 2015 4:05 pm
Replies: 3
by Andy » Tue Apr 28, 2015 1:09 pm

Replies: 3
Views: 2684

Last post by Andy
Tue Apr 28, 2015 4:05 pm
GGA direct band gap to G0W0 indirect band gap

by mailoliver » Fri Apr 17, 2015 5:08 pm
Last post by mmarsili » Mon Apr 20, 2015 3:15 pm
Replies: 3
by mailoliver » Fri Apr 17, 2015 5:08 pm

Replies: 3
Views: 3620

Last post by mmarsili
Mon Apr 20, 2015 3:15 pm
Applying a scissor operator

by rvatanme » Wed Apr 15, 2015 6:59 am
Last post by Daniele Varsano » Wed Apr 15, 2015 12:20 pm
Replies: 1
by rvatanme » Wed Apr 15, 2015 6:59 am

Replies: 1
Views: 2634

Last post by Daniele Varsano
Wed Apr 15, 2015 12:20 pm
Broken PPA Claculation for Germanium

by rvatanme » Thu Mar 26, 2015 9:01 pm
Last post by Daniele Varsano » Tue Mar 31, 2015 2:31 pm
Replies: 7
by rvatanme » Thu Mar 26, 2015 9:01 pm

Replies: 7
Views: 4079

Last post by Daniele Varsano
Tue Mar 31, 2015 2:31 pm
Coulomb cutoff & convergence

by asanchez » Wed Mar 04, 2015 2:01 pm
Last post by asanchez » Thu Mar 05, 2015 11:46 am
Replies: 6
by asanchez » Wed Mar 04, 2015 2:01 pm

Replies: 6
Views: 3554

Last post by asanchez
Thu Mar 05, 2015 11:46 am
G0W0 for a 2D layer

by rnanune » Thu Jan 15, 2015 12:04 am
Last post by Daniele Varsano » Tue Jan 27, 2015 9:38 pm
Replies: 7
by rnanune » Thu Jan 15, 2015 12:04 am

Replies: 7
Views: 5629

Last post by Daniele Varsano
Tue Jan 27, 2015 9:38 pm
Re: Incomplete and/or broken PPA/Static diel. func. in G0W0

by rnanune » Tue Dec 16, 2014 10:55 pm
Last post by Daniele Varsano » Fri Jan 09, 2015 10:11 pm
Replies: 13
by rnanune » Tue Dec 16, 2014 10:55 pm
1

2
Replies: 13
Views: 8767

Last post by Daniele Varsano
Fri Jan 09, 2015 10:11 pm
COHSEX crash (netcdf related?)

by vormar » Mon Jun 06, 2011 3:46 pm
Last post by Daniele Varsano » Tue Jan 06, 2015 9:06 pm
Replies: 7
by vormar » Mon Jun 06, 2011 3:46 pm

Replies: 7
Views: 5389

Last post by Daniele Varsano
Tue Jan 06, 2015 9:06 pm
Germanium bandgap correction

by asanchez » Mon Dec 15, 2014 1:27 pm
Last post by asanchez » Fri Dec 19, 2014 4:32 pm
Replies: 2
by asanchez » Mon Dec 15, 2014 1:27 pm

Replies: 2
Views: 2530

Last post by asanchez
Fri Dec 19, 2014 4:32 pm
bse calculation stop in the step of BSE Diagonalization

by ljzhou86 » Wed Dec 17, 2014 10:28 pm
Last post by Daniele Varsano » Thu Dec 18, 2014 11:36 am
Replies: 3
by ljzhou86 » Wed Dec 17, 2014 10:28 pm

Replies: 3
Views: 2564

Last post by Daniele Varsano
Thu Dec 18, 2014 11:36 am
memory issue in G0W0 run

by BMarco » Tue Nov 22, 2011 11:10 pm
Last post by Daniele Varsano » Mon Dec 15, 2014 1:36 pm
Replies: 7
by BMarco » Tue Nov 22, 2011 11:10 pm

Replies: 7
Views: 6662

Last post by Daniele Varsano
Mon Dec 15, 2014 1:36 pm
nanowire system and coulomb cutoff

by asanchez » Thu Dec 11, 2014 4:02 pm
Last post by asanchez » Thu Dec 11, 2014 5:37 pm
Replies: 2
by asanchez » Thu Dec 11, 2014 4:02 pm

Replies: 2
Views: 2314

Last post by asanchez
Thu Dec 11, 2014 5:37 pm
How to choose converge criteria in GW calculations

by zsjan » Mon Dec 01, 2014 10:43 am
Last post by Daniele Varsano » Mon Dec 01, 2014 2:32 pm
Replies: 3
by zsjan » Mon Dec 01, 2014 10:43 am

Replies: 3
Views: 2714

Last post by Daniele Varsano
Mon Dec 01, 2014 2:32 pm
error

by samaneh » Sat Nov 29, 2014 2:33 pm
Last post by Daniele Varsano » Sat Nov 29, 2014 9:32 pm
Replies: 1
by samaneh » Sat Nov 29, 2014 2:33 pm

Replies: 1
Views: 2044

Last post by Daniele Varsano
Sat Nov 29, 2014 9:32 pm
formation energy

by samaneh » Sun Nov 23, 2014 10:23 am
Last post by Daniele Varsano » Sun Nov 23, 2014 10:45 am
Replies: 1
by samaneh » Sun Nov 23, 2014 10:23 am

Replies: 1
Views: 1461

Last post by Daniele Varsano
Sun Nov 23, 2014 10:45 am

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