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Marking answers for solved issues
by pouillon » Fri Aug 09, 2013 12:56 pm » in Configuring and compiling ABINITThis topic was posted 3910 days ago - 0 Replies
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Last post by pouillon
Fri Aug 09, 2013 12:56 pm
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Error message for double definition of tolXXX [SOLVED]
by mverstra » Mon Apr 01, 2019 2:05 pmThis topic was posted 1849 days ago - 0 Replies
- 23232 Views
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Last post by mverstra
Mon Apr 01, 2019 2:05 pm
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- 2 Replies
- 3408 Views
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Last post by ryne60
Wed Mar 27, 2019 9:35 am
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spin-orbit calculation with HSE functional
by ryne60 » Fri Mar 22, 2019 1:45 pmThis topic was posted 1859 days ago - 2 Replies
- 2108 Views
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Last post by ryne60
Mon Mar 25, 2019 9:35 am
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- 1 Replies
- 1725 Views
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Last post by ebousquet
Fri Mar 22, 2019 5:20 pm
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Calculation in Gamma point only !!!
by rogwar » Wed Mar 20, 2019 11:04 amThis topic was posted 1861 days ago - 1 Replies
- 1917 Views
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Last post by ebousquet
Thu Mar 21, 2019 12:43 pm
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Band structure along symmetry lines using HSE functional
by anhhv » Thu Feb 28, 2019 3:15 pmThis topic was posted 1881 days ago - 2 Replies
- 2447 Views
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Last post by AdamOlejniczak
Tue Mar 19, 2019 9:59 am
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output file of total energy vs acell
by BAMGBOSE, M. K. » Fri Jul 13, 2012 1:19 amThis topic was posted 4303 days ago - 4 Replies
- 3766 Views
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Last post by shalom
Mon Mar 18, 2019 2:55 am
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SCF at small ecut and restart at larger ecut?
by mdsimulationgroup » Sun Mar 10, 2019 1:25 pmThis topic was posted 1871 days ago - 1 Replies
- 1790 Views
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Last post by ebousquet
Thu Mar 14, 2019 3:17 pm
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optcell Questions
by mdsimulationgroup » Sat Mar 09, 2019 1:27 amThis topic was posted 1873 days ago - 1 Replies
- 1811 Views
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Last post by ebousquet
Thu Mar 14, 2019 11:50 am
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SCF at small ecut and restart at larger ecut?
by mdsimulationgroup » Sun Mar 10, 2019 1:21 pmThis topic was posted 1871 days ago - 0 Replies
- 2394 Views
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Last post by mdsimulationgroup
Sun Mar 10, 2019 1:21 pm
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ionmov 1 with H, C, N, O
by mdsimulationgroup » Tue Mar 05, 2019 8:06 pmThis topic was posted 1876 days ago - 1 Replies
- 1823 Views
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Last post by mdsimulationgroup
Fri Mar 08, 2019 6:29 pm
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Pressure parameters [SOLVED]
by jlwindy » Tue Feb 19, 2019 11:35 amThis topic was posted 1890 days ago - 4 Replies
- 3847 Views
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Last post by jlwindy
Sun Mar 03, 2019 7:37 am
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Slab optimization hints?
by mdsimulationgroup » Tue Feb 26, 2019 10:48 pmThis topic was posted 1883 days ago - 1 Replies
- 1843 Views
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Last post by ebousquet
Sat Mar 02, 2019 11:37 am
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restarting scf calculation with a different set of kpoints [SOLVED]
by ryne60 » Fri Mar 01, 2019 1:58 pmThis topic was posted 1880 days ago - 2 Replies
- 3015 Views
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Last post by ryne60
Fri Mar 01, 2019 3:26 pm
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rprim and spacegroup [SOLVED]
by elia » Sun Feb 17, 2019 6:43 pmThis topic was posted 1892 days ago - 5 Replies
- 4184 Views
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Last post by elia
Thu Feb 28, 2019 4:38 am
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Energy increased with more kpoints
by mdsimulationgroup » Tue Feb 26, 2019 12:38 pmThis topic was posted 1883 days ago - 1 Replies
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Last post by ebousquet
Tue Feb 26, 2019 4:01 pm
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ngkpt for geometry optimization
by mdsimulationgroup » Mon Feb 25, 2019 2:32 pmThis topic was posted 1884 days ago - 1 Replies
- 1722 Views
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Last post by ebousquet
Tue Feb 26, 2019 3:52 pm
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Problems obtaining EOS [SOLVED]
by AntonF » Wed Feb 06, 2019 12:52 pmThis topic was posted 1903 days ago - 2 Replies
- 3148 Views
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Last post by AntonF
Fri Feb 22, 2019 11:14 am
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Troubles with relaxation when using ABINIT 8.8.4
by CHILL » Wed Jan 30, 2019 10:55 amThis topic was posted 1910 days ago - 8 Replies
- 5422 Views
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Last post by ebousquet
Thu Feb 21, 2019 5:02 pm
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The rhombohedral phase PZT
by jlwindy » Tue Feb 19, 2019 7:56 amThis topic was posted 1891 days ago - 1 Replies
- 1714 Views
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Last post by jlwindy
Thu Feb 21, 2019 3:14 pm
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ABINIT Documentation is insufficient
by woffermans » Thu Jan 31, 2019 10:48 amThis topic was posted 1909 days ago - 4 Replies
- 3231 Views
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Last post by woffermans
Tue Feb 05, 2019 10:45 am
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FCC and BCC non primitive unit cell
by Hola » Wed Jan 30, 2019 5:13 pmThis topic was posted 1910 days ago - 1 Replies
- 1982 Views
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Last post by ebousquet
Fri Feb 01, 2019 6:00 pm
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Automatic k-point generation
by AntonF » Fri Feb 01, 2019 8:18 amThis topic was posted 1909 days ago - 0 Replies
- 2608 Views
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Last post by AntonF
Fri Feb 01, 2019 8:18 am
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Error: About to overwrite gbound array (FFT mesh too small)
by jbarrat » Mon Dec 17, 2018 11:50 pmThis topic was posted 1954 days ago - 1 Replies
- 1985 Views
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Last post by en victory
Thu Jan 31, 2019 3:51 am
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Reading Image Wavefunctions Restart String Calculation
by woffermans » Tue Jan 29, 2019 12:36 pmThis topic was posted 1911 days ago - 0 Replies
- 2576 Views
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Last post by woffermans
Tue Jan 29, 2019 12:36 pm
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