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Topics Author Replies Views Last Modified
Fe spin numbersSepideh218392014/11/15 02:12
by sepideh
discrepancies results between openmx-siesta-vasp on slab calculation without vdwDuverger Eric226662014/11/14 06:30
by Duverger
I had some error when I tried to install openMXWang Yuanqing221212014/11/12 15:01
by Yuanqing Wang
Transmission Through SiliceneVahid121302014/11/03 19:12
by Artem Pulkin
Installing Openmx with Ifort and IccVahid226462014/10/31 22:23
by Vahid
including hybrid functionalMosahhar024292014/10/28 16:17
by Mosahhar
DFT-D2 Julieth221832014/10/28 04:59
by Julieth
problem with band interpolation using HS.outM. Chen132812014/10/27 22:48
by T. Ozaki
O(N) method in OpenmxChen124202014/10/27 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 Goswami129522014/10/27 22:18
by T. Ozaki
Compile ErrorHossein187832014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone221292014/09/16 01:21
by Leone
problem with grapheneNehmat128242014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee129182014/09/15 22:01
by Artem Pulkin
installation problem Khalid8213842014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan118732014/08/29 18:36
by Artem
One more NEGF issueArtem1349322014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho565892014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen119712014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem127012014/08/18 18:17
by Artem
bandstructure of GaAsZahra144112014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.122412014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan351972014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin026152014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem375042014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen626462014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 338182014/06/10 18:36
by Artem
NEGF Convergence problem Umar 042922014/06/05 17:59
by Umar
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe252252014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1263692014/05/30 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 Kim127762014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren122782014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 137422014/05/23 21:17
by Artem
EvsLCDavid G.121892014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi160482014/05/20 16:23
by T. Ozaki
explanation of transmission khan127272014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone545832014/05/12 22:17
by Artem
OpenMX program automatically exitchow042922014/05/12 12:01
by chow
Files *.bulk.xyzLeone234342014/05/03 01:33
by Leone
MPSHAfshari0269652014/04/24 05:00
by Afshari
Relaxation of MoS2Artem9112462014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3112132014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski167442014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami332502014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep132072014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam122812014/04/10 02:16
by Masoud
==Artem Pulkin368112014/03/17 17:14
by T. Ozaki

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