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ERROR kptopt=0 W90

Last post by resu « Sun Jun 07, 2020 2:28 pm
Posted in Link to other codes

by resu » Sun Jun 07, 2020 2:28 pm » in Link to other codes

0 Replies

1935 Views

Last post by resu
Sun Jun 07, 2020 2:28 pm
ERROR kptopt=0 W90

Last post by resu « Sun Jun 07, 2020 2:18 pm
Posted in Link to other codes

by resu » Sun Jun 07, 2020 2:18 pm » in Link to other codes

0 Replies

1024 Views

Last post by resu
Sun Jun 07, 2020 2:18 pm
Tips for a Large Optic Calculation

Last post by mjwaters « Tue Jun 02, 2020 11:01 pm
Posted in Response calculations

by mjwaters » Tue Jun 02, 2020 11:01 pm » in Response calculations

0 Replies

1166 Views

Last post by mjwaters
Tue Jun 02, 2020 11:01 pm
optical properties

Last post by hameed1987 « Sat May 30, 2020 7:15 am
Posted in Input file

by hameed1987 » Sat May 30, 2020 7:15 am » in Input file

0 Replies

1093 Views

Last post by hameed1987
Sat May 30, 2020 7:15 am
The tarball for 8.10.3.changed

Last post by yurivict « Tue May 19, 2020 9:46 am
Posted in Configuration

by yurivict » Tue May 19, 2020 9:46 am » in Configuration

0 Replies

1227 Views

Last post by yurivict
Tue May 19, 2020 9:46 am
ABINIT v9.0.4 beta release

Last post by gonze « Mon May 18, 2020 10:23 am
Posted in News & Announcements

by gonze » Mon May 18, 2020 10:23 am » in News & Announcements

0 Replies

3184 Views

Last post by gonze
Mon May 18, 2020 10:23 am
Phase transition?

Last post by new_986 « Sat May 16, 2020 11:06 pm
Posted in Theory

by new_986 » Sat May 16, 2020 11:06 pm » in Theory

0 Replies

901 Views

Last post by new_986
Sat May 16, 2020 11:06 pm
error compiling abinit 8.10.3

Last post by lana_ainunnisa « Tue May 12, 2020 11:10 pm
Posted in Configuration

by lana_ainunnisa » Tue May 12, 2020 11:10 pm » in Configuration

0 Replies

750 Views

Last post by lana_ainunnisa
Tue May 12, 2020 11:10 pm
MPI Support is broken Abinit 8.10.1 OpenMPI 3.1.3 Ubuntu 18.04 On Windows

Last post by quantumNoob « Sat May 09, 2020 12:04 am
Posted in Configuration

by quantumNoob » Sat May 09, 2020 12:04 am » in Configuration

0 Replies

763 Views

Last post by quantumNoob
Sat May 09, 2020 12:04 am
The dielectric function within GW approximation

Last post by SMALKI « Tue May 05, 2020 11:47 pm
Posted in GW

by SMALKI » Tue May 05, 2020 11:47 pm » in GW

0 Replies

643 Views

Last post by SMALKI
Tue May 05, 2020 11:47 pm
The dielectric function within GW approximation

Last post by SMALKI « Tue May 05, 2020 11:47 pm
Posted in GW

by SMALKI » Tue May 05, 2020 11:47 pm » in GW

0 Replies

604 Views

Last post by SMALKI
Tue May 05, 2020 11:47 pm
ABINIT v9.0.3 beta release

Last post by gonze « Wed Apr 22, 2020 10:09 am
Posted in News & Announcements

by gonze » Wed Apr 22, 2020 10:09 am » in News & Announcements

0 Replies

2694 Views

Last post by gonze
Wed Apr 22, 2020 10:09 am
ABINIT v9.0.2 beta release

Last post by gonze « Mon Mar 30, 2020 2:43 pm
Posted in News & Announcements

by gonze » Mon Mar 30, 2020 2:43 pm » in News & Announcements

0 Replies

2832 Views

Last post by gonze
Mon Mar 30, 2020 2:43 pm
Where to find LDA and hybrid pseudopotentials

Last post by erichmond « Thu Mar 26, 2020 4:25 am
Posted in Pseudopotentials and PAW datasets

by erichmond » Thu Mar 26, 2020 4:25 am » in Pseudopotentials and PAW datasets

0 Replies

770 Views

Last post by erichmond
Thu Mar 26, 2020 4:25 am
Error Running AIM Utility (valence electron mismatch while using .FC file from website)

Last post by pk4 « Wed Mar 25, 2020 11:11 pm
Posted in Post-processing Tools

by pk4 » Wed Mar 25, 2020 11:11 pm » in Post-processing Tools

0 Replies

680 Views

Last post by pk4
Wed Mar 25, 2020 11:11 pm
Visualizing STM maps

Last post by Czetch « Sun Mar 22, 2020 8:07 pm
Posted in Post-processing Tools

by Czetch » Sun Mar 22, 2020 8:07 pm » in Post-processing Tools

0 Replies

427 Views

Last post by Czetch
Sun Mar 22, 2020 8:07 pm
GW First Run

Last post by hameed1987 « Sun Mar 22, 2020 3:01 pm
Posted in GW

by hameed1987 » Sun Mar 22, 2020 3:01 pm » in GW

0 Replies

492 Views

Last post by hameed1987
Sun Mar 22, 2020 3:01 pm
String method tutorial

Last post by EchoTheCat « Sun Mar 22, 2020 5:56 am
Posted in Input file

by EchoTheCat » Sun Mar 22, 2020 5:56 am » in Input file

0 Replies

400 Views

Last post by EchoTheCat
Sun Mar 22, 2020 5:56 am
wavefunctions from _WFK file

Last post by wenfei « Mon Feb 03, 2020 3:32 am
Posted in Post-processing Tools

by wenfei » Mon Feb 03, 2020 3:32 am » in Post-processing Tools

0 Replies

460 Views

Last post by wenfei
Mon Feb 03, 2020 3:32 am
structural optimization for monolayer In2Se3

Last post by suman « Thu Jan 30, 2020 4:25 pm
Posted in Input file

by suman » Thu Jan 30, 2020 4:25 pm » in Input file

0 Replies

401 Views

Last post by suman
Thu Jan 30, 2020 4:25 pm
Structural optimization for monolayer In2Se3

Last post by suman « Fri Jan 24, 2020 6:11 pm
Posted in Input file

by suman » Fri Jan 24, 2020 6:11 pm » in Input file

0 Replies

424 Views

Last post by suman
Fri Jan 24, 2020 6:11 pm
Temperature-dependency and temperature_final.py script

Last post by MasoudMS « Wed Jan 01, 2020 10:31 am
Posted in Post-processing Tools

by MasoudMS » Wed Jan 01, 2020 10:31 am » in Post-processing Tools

0 Replies

773 Views

Last post by MasoudMS
Wed Jan 01, 2020 10:31 am
how to convert the file format

Last post by M-guodong « Mon Dec 23, 2019 6:12 pm
Posted in Post-processing Tools

by M-guodong » Mon Dec 23, 2019 6:12 pm » in Post-processing Tools

0 Replies

498 Views

Last post by M-guodong
Mon Dec 23, 2019 6:12 pm
netcdf error One or more variable sizes violate format constraints

Last post by abderrezak « Mon Dec 09, 2019 4:14 pm
Posted in GW

by abderrezak » Mon Dec 09, 2019 4:14 pm » in GW

0 Replies

826 Views

Last post by abderrezak
Mon Dec 09, 2019 4:14 pm
Second order non-linear optical response using GW or BSE

Last post by Maksim « Tue Nov 12, 2019 9:13 am
Posted in GW

by Maksim » Tue Nov 12, 2019 9:13 am » in GW

0 Replies

527 Views

Last post by Maksim
Tue Nov 12, 2019 9:13 am

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