OpenMX Forum
New Thread | Return Home | Points of Concern | Search | Past Log | Administration    

List of Threads

Topics Author Replies Views Last Modified
localised and itinerant electron specificationTamal Goswami117862014/10/27 22:18
by T. Ozaki
Compile ErrorHossein124692014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone210102014/09/16 01:21
by Leone
problem with grapheneNehmat113222014/09/15 22:33
by Artem Pulkin
Segmentation fault : NEGF step.1 The calculations for leads Lee117272014/09/15 22:01
by Artem Pulkin
installation problem Khalid8186682014/09/10 11:14
by T.V.T. Duy
lapack subroutines for diagonizationJohn Chan16872014/08/29 18:36
by Artem
One more NEGF issueArtem1331082014/08/25 21:03
by Artem
Dipole correction for slab calculationSung Beom Cho532302014/08/21 16:51
by T. Ozaki
FFT of atomic orbitalsM. Chen17962014/08/20 09:25
by T. Ozaki
One more question about NEGF performanceArtem115342014/08/18 18:17
by Artem
bandstructure of GaAsZahra130342014/08/11 17:13
by T. Ozaki
ADPACK calculations for ions etc.M. O.110062014/08/11 17:09
by T. Ozaki
Gold nanowire NEGF simulation no convergenceHassan337872014/08/09 05:43
by Hassan Farooq
MPSH enabled OPENMX Jaber Jahanbin014252014/06/22 22:48
by Jaber Jahanbin
Bi2Te3 topological insulatorArtem341242014/06/21 10:11
by T. Ozaki
small residule charges after SCF is completedChen612282014/06/16 15:24
by T. Ozaki
NEGF Convergence problem in Magnetic junction Umar 322932014/06/10 18:36
by Artem
NEGF Convergence problem Umar 029032014/06/05 17:59
by Umar
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe236152014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1243302014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin628392014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim113752014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren111422014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 125532014/05/23 21:17
by Artem
EvsLCDavid G.110792014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi146042014/05/20 16:23
by T. Ozaki
explanation of transmission khan114712014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone533372014/05/12 22:17
by Artem
OpenMX program automatically exitchow028372014/05/12 12:01
by chow
Files *.bulk.xyzLeone220502014/05/03 01:33
by Leone
MPSHAfshari0258082014/04/24 05:00
by Afshari
Relaxation of MoS2Artem963102014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez390572014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski154322014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami317022014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep116832014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam19922014/04/10 02:16
by Masoud
==Artem Pulkin356212014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin113632014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai155142014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music115292014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep112402014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso323042014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki018142014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ114712014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie214832014/02/07 04:43
by Yu Xie
unit of cube fileJ328562014/01/31 23:32
by J
Patch 3.7.7 to OpenMX Ver. 3.7T. Ozaki047192014/01/31 17:40
by T. Ozaki
Kohn Sham energy levels and Hartree potentialLe The Anh936702014/01/29 18:34
by Le The Anh

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17]


Open Thread    Locked Thread    Alarm(More than 90 replies)   Message from Administrator


- Web Patio -