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Topics Author Replies Views Last Modified
patches for gcc-4.8.3/4.9.1marcindulak113732014/10/27 22:30
by T. Ozaki
Optimized norm-conserving Vanderbilt pseudopotentialschrinide119772014/10/27 22:26
by T. Ozaki
localised and itinerant electron specificationTamal Goswami122982014/10/27 22:18
by T. Ozaki
Compile ErrorHossein146972014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone214842014/09/16 01:21
by Leone
problem with grapheneNehmat120992014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee122382014/09/15 22:01
by Artem Pulkin
installation problem Khalid8202582014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan111812014/08/29 18:36
by Artem
One more NEGF issueArtem1339322014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho553082014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen113012014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem120562014/08/18 18:17
by Artem
bandstructure of GaAsZahra136182014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.115262014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan344582014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin019452014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem365192014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen619002014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 331012014/06/10 18:36
by Artem
NEGF Convergence problem Umar 036322014/06/05 17:59
by Umar
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe244862014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1253682014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin636482014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim120482014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren116272014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 131022014/05/23 21:17
by Artem
EvsLCDavid G.115572014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi153372014/05/20 16:23
by T. Ozaki
explanation of transmission khan120032014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone539292014/05/12 22:17
by Artem
OpenMX program automatically exitchow035632014/05/12 12:01
by chow
Files *.bulk.xyzLeone227162014/05/03 01:33
by Leone
MPSHAfshari0262772014/04/24 05:00
by Afshari
Relaxation of MoS2Artem991152014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3101372014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski160362014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami324302014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep124432014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam115922014/04/10 02:16
by Masoud
==Artem Pulkin361892014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin120252014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai160712014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music121632014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep117792014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso329952014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki023332014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ120282014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie220132014/02/07 04:43
by Yu Xie
unit of cube fileJ338242014/01/31 23:32
by J

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