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Topics Author Replies Views Last Modified
stop without scf convergence and ESM problemschi158322014/05/20 16:23
by T. Ozaki
explanation of transmission khan125212014/05/16 18:50
by Artem
Question about vector unity cell in Au(1 1 1) surfaceLeone543762014/05/12 22:17
by Artem
OpenMX program automatically exitchow040672014/05/12 12:01
by chow
Files *.bulk.xyzLeone231962014/05/03 01:33
by Leone
MPSHAfshari0267322014/04/24 05:00
by Afshari
Relaxation of MoS2Artem9103672014/04/16 08:52
by T. Ozaki
Vacuum levelAlfonso Sanchez3108392014/04/16 06:28
by Alfonso Sanchez
problem with calculation of forcesAndrzej Lusakowski165142014/04/14 15:33
by T. Ozaki
non-collinear DFT: problem in fixing spin orientationTamal Goswami330102014/04/14 15:29
by T. Ozaki
Problem in making DosMain fileDUONG Dinh Hiep129882014/04/14 15:27
by T. Ozaki
Installation problem of openmx3.7 on fedora core 19Md. Mehboob Alam120662014/04/10 02:16
by Masoud
==Artem Pulkin365962014/03/17 17:14
by T. Ozaki
Problem about Graphenewdaobin125432014/03/17 17:06
by T. Ozaki
pseudopotential and atomic basis dai165472014/03/17 16:51
by T. Ozaki
Visualization of OpenMX dataDenis Music126992014/03/17 16:48
by T. Ozaki
Change the number of data point in Density of States calculationDUONG Dinh Hiep122282014/03/17 16:36
by T. Ozaki
Optimised ZnO (1010) nonpolar surfaceMoh. Adhib Ulil Abso335222014/02/20 12:13
by Moh Adhib Ulil Abso
Patch 3.7.8 to OpenMX Ver. 3.7T. Ozaki027612014/02/17 12:16
by T. Ozaki
Current in *.current file from NEGFJ124912014/02/07 15:35
by T. Ozaki
Running openMX on Cray XC30 Yu Xie224812014/02/07 04:43
by Yu Xie
unit of cube fileJ347732014/01/31 23:32
by J
Patch 3.7.7 to OpenMX Ver. 3.7T. Ozaki056362014/01/31 17:40
by T. Ozaki
Kohn Sham energy levels and Hartree potentialLe The Anh961012014/01/29 18:34
by Le The Anh
Exchange coupling of Fe atoms- first nearest neighbor Kamaram Munira167142014/01/28 09:47
by T. Ozaki
pseudopotential for positive charged atomsJT124832014/01/28 09:44
by T. Ozaki
Mr.Yu Xie174882014/01/24 02:25
by Yu Xie
My first postImeldran019412013/12/27 02:21
by Imeldran
charge density in a given energy rangeJ224872013/12/25 12:56
by J
light speed in the codeWenLiang_liu128182013/12/25 04:21
by T. Ozaki
<RF> ERROR, aborting yugd121882013/12/25 04:16
by T. Ozaki
Atom projected band structureEike Schwier123892013/12/25 04:13
by T. Ozaki
Stress calculationSomesh Bhattacharya121982013/12/25 04:11
by T. Ozaki
I(V) for graphene ribbonPeter122502013/12/25 04:09
by T. Ozaki
Energy landscape discontinuitiesJure Varlec124262013/12/25 04:03
by T. Ozaki
Very difficult scf-convergence for NEGF calculationsyugd124302013/12/21 12:06
by yugd
light speed WenLiang_liu019712013/12/13 18:02
by WenLiang_liu
Wrong transmission yugd134222013/11/20 21:40
by yugd
Relativistic effectsCristian Morari223222013/11/01 19:39
by Cristian Morari
Transmission on a graphene sheet (a 2 dimensional system)yugd123632013/10/31 13:11
by T. Ozaki
makefile for sr16k machine in tokyoVikas Sharma122202013/10/23 18:00
by T. Ohwaki
Turning off MD calculationVijay Shankar 124522013/10/23 17:52
by T. Ozaki
Is the Hartree potential computed in parallel?Jlrch120662013/10/23 17:46
by T. Ozaki
MO output in spin orbital coupling caculationYS Siew122372013/10/23 17:42
by T. Ozaki
SCF problem!Javan1182552013/09/25 04:45
by JAVAN
problems on the geometry optimization of grapheneyugd379732013/09/18 08:51
by yugd
relation between scf.energycutoff and scf.Ngriddchrobak197492013/09/17 23:10
by T. Ozaki
my first impression of openmxyugd193922013/09/17 22:41
by T. Ozaki
Fock MatrixRuibin Liu122472013/09/17 22:32
by T. Ozaki
about scf.system.chargeN.Kolchenko118392013/09/05 05:08
by N.Kolchenko

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