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

List of Threads

Topics Author Replies Views Last Modified
molecular-projected self-consistent Hamiltonian (MPSH)David Sharpe235732014/06/02 17:47
by Sharpe & Afshari
Spin Polarization NEGF Calculation Umar 1242802014/05/30 23:48
by Umar
Present wf in real spaceArtem Pulkin628142014/05/29 21:31
by T. Ozaki
MPI error in cluster SCF eigenvaluesolver (OpenMX3.7)Jae Nyeong Kim113512014/05/27 23:50
by Artem
Bug in MIN/MAX macros causing incorrect resultsÅke Sandgren111142014/05/23 22:28
by T. Ozaki
Piloting over-all transmission of the system Umar 125222014/05/23 21:17
by Artem
EvsLCDavid G.110482014/05/20 16:32
by T. Ozaki
stop without scf convergence and ESM problemschi145702014/05/20 16:23
by T. Ozaki
explanation of transmission khan114382014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone533082014/05/12 22:17
by Artem
OpenMX program automatically exitchow028052014/05/12 12:01
by chow
Files *.bulk.xyzLeone220162014/05/03 01:33
by Leone
MPSHAfshari0257762014/04/24 05:00
by Afshari
Relaxation of MoS2Artem961562014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez390162014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski153952014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami316752014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep116452014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam19572014/04/10 02:16
by Masoud
==Artem Pulkin356002014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin113302014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai154862014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music114982014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep112112014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso322782014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki017842014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ114512014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie214602014/02/07 04:43
by Yu Xie
unit of cube fileJ328222014/01/31 23:32
by J
Patch 3.7.7 to OpenMX Ver. 3.7T. Ozaki046892014/01/31 17:40
by T. Ozaki
Kohn Sham energy levels and Hartree potentialLe The Anh936452014/01/29 18:34
by Le The Anh
Exchange coupling of Fe atoms- first nearest neighbor Kamaram Munira152452014/01/28 09:47
by T. Ozaki
pseudopotential for positive charged atomsJT114662014/01/28 09:44
by T. Ozaki
Mr.Yu Xie165142014/01/24 02:25
by Yu Xie
My first postImeldran010172013/12/27 02:21
by Imeldran
charge density in a given energy rangeJ214732013/12/25 12:56
by J
light speed in the codeWenLiang_liu118382013/12/25 04:21
by T. Ozaki
<RF> ERROR, aborting yugd112402013/12/25 04:16
by T. Ozaki
Atom projected band structureEike Schwier113432013/12/25 04:13
by T. Ozaki
Stress calculationSomesh Bhattacharya111572013/12/25 04:11
by T. Ozaki
I(V) for graphene ribbonPeter112752013/12/25 04:09
by T. Ozaki
Energy landscape discontinuitiesJure Varlec114022013/12/25 04:03
by T. Ozaki
Very difficult scf-convergence for NEGF calculationsyugd113852013/12/21 12:06
by yugd
light speed WenLiang_liu010352013/12/13 18:02
by WenLiang_liu
Wrong transmission yugd120582013/11/20 21:40
by yugd
Relativistic effectsCristian Morari213182013/11/01 19:39
by Cristian Morari
Transmission on a graphene sheet (a 2 dimensional system)yugd113352013/10/31 13:11
by T. Ozaki
makefile for sr16k machine in tokyoVikas Sharma112512013/10/23 18:00
by T. Ohwaki
Turning off MD calculationVijay Shankar 112862013/10/23 17:52
by T. Ozaki
Is the Hartree potential computed in parallel?Jlrch110662013/10/23 17:46
by T. Ozaki

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


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


- Web Patio -