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Topics Author Replies Views Last Modified
Noisy output for sden.cube fileMaedeh510622020/03/04 17:02
by Maedeh
installation error OpenMX ver 3.9Maedeh8576352020/02/26 13:12
by Naoya Yamaguchi
How to read *.scfout file?Zafer Kandemir216302020/02/22 18:27
by Zafer Kandemir
Difference in the total charge density from ESM on4Alia Mejri110332020/02/22 00:01
by T. Ozaki
Fermi level is not set to zero noopur217612020/02/19 20:23
by T. Ozaki
Zeeman term in the OpenMx3.9 have problemUmar farooq411592020/02/12 19:33
by Umar farooq
Patch 3.9.2 to OpenMX Ver. 3.9T. Ozaki010792020/02/11 22:44
by T. Ozaki
NEGF convergence making loopVikash211252020/02/07 01:02
by T. Ozaki
Mailing list for the OpenMX ForumT. Ozaki09922020/02/06 23:09
by T. Ozaki
NEB simulationYuki Kamikawa210282020/01/30 21:00
by Yuki Kamikawa
NEB memory and parallel problemsReza611742020/01/29 00:41
by T. Ozaki
DosMain issue in metal-graphene heterostructures Samuel Dechamps110612020/01/25 13:51
by T. Ozaki
cygwin_exception::open_stackdumpfile: Dumping stackmasood297842020/01/22 02:05
by masood
core dumped in the exchange coupling calculation (Jx) for Mn12 Po-Hao 213302020/01/20 16:07
by Asako Terasawa
LzSz only spin-orbit coupling in collinear spin calculation?Asako Terasawa714402020/01/19 22:41
by Alireza Baradaran
Error in compiling openmx3.9Xiaoxiong228222020/01/18 16:31
by Xiaoxiong
Cannot finish the NEGF testrunK. Yamaguchi414882020/01/18 12:34
by T. Ozaki
error installation in openmx3.9Alireza Baradaran110222020/01/18 00:30
by Alireza Baradaran
Problem with jx in ver 3.9.1Zsolt512602020/01/17 11:29
by Asako Terasawa
Bad convergence for calculations with an electric field Chen110072020/01/16 13:35
by Po-Hao
NEGF zgetrf failed errormasood09232020/01/14 03:56
by masood
Error in installing openmx with intel mpi compiler and mkl Chen520382020/01/13 18:07
by Chen
NEGF Convergence problemVikash412472020/01/09 18:53
by Vikash
The convergence of RFC5Alisa110422020/01/02 15:51
by T. Ozaki
Patch 3.9.1 to OpenMX Ver. 3.9T. Ozaki09842020/01/02 15:40
by T. Ozaki
formate of seed_name.AtomMulP genrated by kSpinUmar farooq1114882019/12/31 11:57
by Naoya Yamaguchi
NEGF calculation of OpenMX Ver 3.9Xingqiang SHI212072019/12/30 16:39
by Xingqiang SHI
Forces of same structure gotten from openmx are a lot different from that from vaspZuzhang Lin214342019/12/25 01:27
by Zuzhang Lin
Question about '.md2' file.Liu Jie410372019/12/23 15:30
by Liu Jie
Higher Bond length of Arsenous acidLovleen Kaur213732019/12/18 18:20
by T. Ozaki
which paramiter can control the maximum step?Liu Jie1011842019/12/18 12:01
by Liu Jie
pseudopotentials for ionsM Chen214002019/12/17 16:35
by Chen
How to obtain the initial charge?Liu Jie110562019/12/16 23:19
by T. Ozaki
Error when Installing 3.9 version kmaz111452019/12/11 22:53
by Mitsuaki Kawamura
Release of OpenMX Ver 3.9T. Ozaki212592019/12/11 21:33
by T. Ozaki
NEGF calculations converge to unphysical results when 2 leads are differentMaxim Visotin315402019/11/25 22:02
by Artem Pulkin
compiler error for Intel Compilers and MKL Libraryzhiying guo110292019/11/23 14:56
by Naoya Yamaguchi
Re: Installation of openmx in ubuntudeniz627392019/10/25 11:06
by Naoya Yamaguchi
SOLVED Bug on JX with Energy.Decomposition ONJhon W. Gonzalez212292019/10/20 11:04
by Jhon W. Gonzalez
(Maybe) fixing Vdw-d3(bj)Jhon W. Gonzalez323892019/10/16 13:41
by T. Ozaki
A sharing package for new version (2019) of PAO and VPSKylin012762019/10/06 09:25
by Kylin
stress calculationHoi111862019/09/21 11:35
by T. Ozaki
DFT+SOC --- bandgnu13 generates only BANDDAT1 file.Maedeh416442019/09/20 23:42
by Maedeh
nan error in optimization of Fe doped Arm chair graphene nano ribbonLovleen Kaur111662019/09/19 11:02
by Jhon W. Gonzalez
Nose-Hoover heat bath massPavel Ondracka116382019/09/16 12:49
by Naoya Yamaguchi
Compiling Jx executable in ubuntuAltan414102019/09/09 17:17
by Altan
orbital contributions of exchange coupling parametersBin Shao214302019/09/04 11:28
by Hongkee Yoon
Solvent modelLovleen Kaur010552019/09/02 18:22
by Lovleen Kaur
Understanding exchange coupling parameter calculationJhon W. Gonzalez012252019/08/30 07:26
by Jhon W. Gonzalez
optimization lattice constants of charged single layer 2d metallic materialsBin Shao011252019/08/27 14:03
by Bin Shao

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