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Topics Author Replies Views Last Modified
patches for gcc-4.8.3/4.9.1marcindulak115172014/10/27 22:30
by T. Ozaki
Optimized norm-conserving Vanderbilt pseudopotentialschrinide120972014/10/27 22:26
by T. Ozaki
localised and itinerant electron specificationTamal Goswami123792014/10/27 22:18
by T. Ozaki
Compile ErrorHossein150412014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone215932014/09/16 01:21
by Leone
problem with grapheneNehmat122212014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee123282014/09/15 22:01
by Artem Pulkin
installation problem Khalid8205152014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan112932014/08/29 18:36
by Artem
One more NEGF issueArtem1341122014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho554882014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen114002014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem121482014/08/18 18:17
by Artem
bandstructure of GaAsZahra137242014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.116262014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan345602014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin020322014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem366692014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen620222014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 332452014/06/10 18:36
by Artem
NEGF Convergence problem Umar 037412014/06/05 17:59
by Umar
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe246022014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1255582014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin637752014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim121662014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren117392014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 131892014/05/23 21:17
by Artem
EvsLCDavid G.116522014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi154562014/05/20 16:23
by T. Ozaki
explanation of transmission khan120892014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone540332014/05/12 22:17
by Artem
OpenMX program automatically exitchow036862014/05/12 12:01
by chow
Files *.bulk.xyzLeone228272014/05/03 01:33
by Leone
MPSHAfshari0263722014/04/24 05:00
by Afshari
Relaxation of MoS2Artem994372014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3102802014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski161452014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami325742014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep126102014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam117032014/04/10 02:16
by Masoud
==Artem Pulkin362672014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin121292014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai161702014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music122902014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep118722014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso331022014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki024312014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ121352014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie221272014/02/07 04:43
by Yu Xie
unit of cube fileJ340092014/01/31 23:32
by J

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