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Topics Author Replies Views Last Modified
Fe spin numbersSepideh218382014/11/15 02:12
by sepideh
discrepancies results between openmx-siesta-vasp on slab calculation without vdwDuverger Eric226642014/11/14 06:30
by Duverger
I had some error when I tried to install openMXWang Yuanqing221202014/11/12 15:01
by Yuanqing Wang
Transmission Through SiliceneVahid121292014/11/03 19:12
by Artem Pulkin
Installing Openmx with Ifort and IccVahid226442014/10/31 22:23
by Vahid
including hybrid functionalMosahhar024272014/10/28 16:17
by Mosahhar
DFT-D2 Julieth221822014/10/28 04:59
by Julieth
problem with band interpolation using HS.outM. Chen132802014/10/27 22:48
by T. Ozaki
O(N) method in OpenmxChen124182014/10/27 22:41
by T. Ozaki
patches for gcc-4.8.3/4.9.1marcindulak122492014/10/27 22:30
by T. Ozaki
Optimized norm-conserving Vanderbilt pseudopotentialschrinide127522014/10/27 22:26
by T. Ozaki
localised and itinerant electron specificationTamal Goswami129512014/10/27 22:18
by T. Ozaki
Compile ErrorHossein187822014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone221272014/09/16 01:21
by Leone
problem with grapheneNehmat128232014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee129172014/09/15 22:01
by Artem Pulkin
installation problem Khalid8213832014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan118712014/08/29 18:36
by Artem
One more NEGF issueArtem1349312014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho565862014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen119702014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem126992014/08/18 18:17
by Artem
bandstructure of GaAsZahra144112014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.122392014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan351962014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin026132014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem375042014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen626452014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 338162014/06/10 18:36
by Artem
NEGF Convergence problem Umar 042902014/06/05 17:59
by Umar
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe252232014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1263652014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin644912014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim127752014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren122772014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 137402014/05/23 21:17
by Artem
EvsLCDavid G.121882014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi160462014/05/20 16:23
by T. Ozaki
explanation of transmission khan127262014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone545822014/05/12 22:17
by Artem
OpenMX program automatically exitchow042912014/05/12 12:01
by chow
Files *.bulk.xyzLeone234332014/05/03 01:33
by Leone
MPSHAfshari0269632014/04/24 05:00
by Afshari
Relaxation of MoS2Artem9112392014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3112102014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski167432014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami332492014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep132062014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam122792014/04/10 02:16
by Masoud
==Artem Pulkin368102014/03/17 17:14
by T. Ozaki

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