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

List of Threads

Topics Author Replies Views Last Modified
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe244472014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1253182014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin636132014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim120152014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren115952014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 130692014/05/23 21:17
by Artem
EvsLCDavid G.115292014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi153022014/05/20 16:23
by T. Ozaki
explanation of transmission khan119732014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone538972014/05/12 22:17
by Artem
OpenMX program automatically exitchow035282014/05/12 12:01
by chow
Files *.bulk.xyzLeone226862014/05/03 01:33
by Leone
MPSHAfshari0262472014/04/24 05:00
by Afshari
Relaxation of MoS2Artem989882014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3100902014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski159992014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami323952014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep123932014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam115522014/04/10 02:16
by Masoud
==Artem Pulkin361612014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin119922014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai160442014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music121182014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep117512014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso329662014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki023062014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ119992014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie219852014/02/07 04:43
by Yu Xie
unit of cube fileJ337572014/01/31 23:32
by J
Patch 3.7.7 to OpenMX Ver. 3.7T. Ozaki051972014/01/31 17:40
by T. Ozaki
Kohn Sham energy levels and Hartree potentialLe The Anh950002014/01/29 18:34
by Le The Anh
Exchange coupling of Fe atoms- first nearest neighbor Kamaram Munira160492014/01/28 09:47
by T. Ozaki
pseudopotential for positive charged atomsJT119812014/01/28 09:44
by T. Ozaki
Mr.Yu Xie170202014/01/24 02:25
by Yu Xie
My first postImeldran014852013/12/27 02:21
by Imeldran
charge density in a given energy rangeJ219632013/12/25 12:56
by J
light speed in the codeWenLiang_liu123522013/12/25 04:21
by T. Ozaki
<RF> ERROR, aborting yugd117052013/12/25 04:16
by T. Ozaki
Atom projected band structureEike Schwier119112013/12/25 04:13
by T. Ozaki
Stress calculationSomesh Bhattacharya117212013/12/25 04:11
by T. Ozaki
I(V) for graphene ribbonPeter117502013/12/25 04:09
by T. Ozaki
Energy landscape discontinuitiesJure Varlec119242013/12/25 04:03
by T. Ozaki
Very difficult scf-convergence for NEGF calculationsyugd119132013/12/21 12:06
by yugd
light speed WenLiang_liu015152013/12/13 18:02
by WenLiang_liu
Wrong transmission yugd128092013/11/20 21:40
by yugd
Relativistic effectsCristian Morari218542013/11/01 19:39
by Cristian Morari
Transmission on a graphene sheet (a 2 dimensional system)yugd118642013/10/31 13:11
by T. Ozaki
makefile for sr16k machine in tokyoVikas Sharma117572013/10/23 18:00
by T. Ohwaki
Turning off MD calculationVijay Shankar 119272013/10/23 17:52
by T. Ozaki
Is the Hartree potential computed in parallel?Jlrch115792013/10/23 17:46
by T. Ozaki

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17] [18] [19] [20] [21] [22] [23]


Open Thread    Locked Thread    Alarm(More than 180 replies)   Message from Administrator


- Web Patio -