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Topics Author Replies Views Last Modified
scf convergence problem of Pt(111) slabWang Yuanqing108742015/02/10 21:45
by T. Ozaki
pseudo-atomic basis orbitalsRiemann15802015/02/10 21:38
by T. Ozaki
how to read *.md file using XCrySDen softwareWang Yuanqing37412015/02/10 19:13
by Denis Music
Total energy in NEGFArtem Pulkin61462015/01/29 18:56
by Artem Pulkin
Transmisson through siliceneVahid04152015/01/22 20:23
by Vahid
MLWF obtained from OpenMXGuodong Yu46692015/01/22 11:10
by Guodong Yu
Electrostatic potential between leads in NEGF transport calculationsKonstantin Khromov24892015/01/20 19:45
by Konstantin Khromov
gcc errorWilliam15472014/12/15 14:27
by T.V.T. Duy
problem about example Gly_NH.datWang Yuanqing24772014/12/12 10:46
by Yuanqing Wang
The 3rd OpenMX/QMAS workshopT. Ozaki06732014/12/11 23:56
by T. Ozaki
mismatched energy values on same symmetry pointsKuraya35352014/12/11 22:12
by T. Ozaki
no error no run!masoud14482014/12/11 01:24
by Artem Pulkin
md calculation errorWang Yuanqing15282014/12/10 19:09
by Artem Pulkin
PAO and VPS for CarbonKonstantin Khromov26042014/11/27 06:26
by T. Ozaki
DoctorKonstantin Khromov15132014/11/26 20:29
by Konstantin Khromov
INput file for Bi2Se3ANANT15782014/11/24 20:12
by Artem Pulkin
Writing the code for (1,1,1) surface for any crystal ANANT14812014/11/23 08:29
by T. Ozaki
Question about non-collinear MLWF calculationLimillas17202014/11/23 08:26
by T. Ozaki
VPS and PAO for TerbiumM. M. Anas25902014/11/21 19:05
by M. M. Anas
NEGF and insulatorsArtem Pulkin16342014/11/21 00:09
by T. Ozaki
Fe spin numbersSepideh26032014/11/15 02:12
by sepideh
discrepancies results between openmx-siesta-vasp on slab calculation without vdwDuverger Eric28432014/11/14 06:30
by Duverger
I had some error when I tried to install openMXWang Yuanqing27392014/11/12 15:01
by Yuanqing Wang
Transmission Through SiliceneVahid17582014/11/03 19:12
by Artem Pulkin
Installing Openmx with Ifort and IccVahid213872014/10/31 22:23
by Vahid
including hybrid functionalMosahhar06062014/10/28 16:17
by Mosahhar
DFT-D2 Julieth29922014/10/28 04:59
by Julieth
problem with band interpolation using HS.outM. Chen118762014/10/27 22:48
by T. Ozaki
O(N) method in OpenmxChen110902014/10/27 22:41
by T. Ozaki
patches for gcc-4.8.3/4.9.1marcindulak16592014/10/27 22:30
by T. Ozaki
Optimized norm-conserving Vanderbilt pseudopotentialschrinide112482014/10/27 22:26
by T. Ozaki
localised and itinerant electron specificationTamal Goswami117592014/10/27 22:18
by T. Ozaki
Compile ErrorHossein123772014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone29842014/09/16 01:21
by Leone
problem with grapheneNehmat112912014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee117022014/09/15 22:01
by Artem Pulkin
installation problem Khalid8186022014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan16572014/08/29 18:36
by Artem
One more NEGF issueArtem1330822014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho531072014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen17692014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem115112014/08/18 18:17
by Artem
bandstructure of GaAsZahra130052014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.19752014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan337512014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin013982014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem340732014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen612002014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 322442014/06/10 18:36
by Artem
NEGF Convergence problem Umar 028722014/06/05 17:59
by Umar

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