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About building OpenMX on ubuntuhiroaki tanzawa07382020/05/26 18:24
by hiroaki tanzawa
Openmx 3.9 compilation sometimes freezes after "outputting data on grids to files..."Christopher68602020/05/14 15:23
by T. Ozaki
NEB calculation with lattice constant changeYuki S.17342020/05/14 15:10
by T. Ozaki
Problem about 'make DosMain'Liu Jie211532020/05/08 16:41
by Liu Jie
Constraint DFT for non-collinear spin orientation-problem in fixing spin orientationMaedeh28942020/04/27 20:06
by Maedeh
Changing of kpath and re-calculating.Victor38122020/04/25 02:33
by Victor
The definition for initial spin directionChong Wang511172020/04/24 13:37
by Chong Wang
Where in source code is the LCAO decomposition printed to .out file?P47522020/04/24 06:17
by P
Parameter setting for molecular dynamics(NVT_NH)cpniu18472020/04/23 14:55
by Naoya Yamaguchi
NEGF issuesLuca Sementa08142020/04/03 05:26
by Luca Sementa
OpenMX 3.9 ELPA MPI/OpenMP hybridPui Wai (Leo) Ma411022020/04/02 17:06
by Pui Wai (Leo) Ma
scf.Ngrid estimateLuca Sementa38982020/04/02 03:14
by Luca Sementa
Segmentation fault (signal 11)VictorS520672020/03/30 20:20
by VictorS
Euler AngleMahyar414152020/03/29 15:58
by Mahyar
Memory exhaustion by cell optimizationHikaru Sawahata29702020/03/28 23:15
by T. Ozaki
BerryFlux in slandered output file of calB Umar farooq610212020/03/28 20:13
by Hikaru Sawahata
PMPI_Comm_size: Invalid communicator, error Garret Wong322122020/03/27 11:40
by Garret Wong
Surface polarizationN.V.Hoi17232020/03/24 09:34
by T. Ozaki
Japanese Manual of OpenMX Ver. 3.9T. Ozaki07192020/03/21 17:47
by T. Ozaki
Error installing patch 3.9.2 Samuel Dechamps28732020/03/20 02:02
by Samuel Dechamps
Spin symbolF16732020/03/12 13:52
by Naoya Yamaguchi
calculation time for a small systemYongsheng Zhang48682020/03/09 09:56
by T. Ozaki
constraining magnetic fieldYun-Peng Wang38802020/03/09 09:54
by T. Ozaki
ASE-OPENMX for NEB calculationReza29762020/03/08 08:51
by T. Ozaki
scissors correction in the optics calculationsJian Zhou27452020/03/05 00:16
by Jian Zhou
Noisy output for sden.cube fileMaedeh57952020/03/04 17:02
by Maedeh
installation error OpenMX ver 3.9Maedeh8566742020/02/26 13:12
by Naoya Yamaguchi
How to read *.scfout file?Zafer Kandemir211682020/02/22 18:27
by Zafer Kandemir
Difference in the total charge density from ESM on4Alia Mejri17472020/02/22 00:01
by T. Ozaki
Fermi level is not set to zero noopur212982020/02/19 20:23
by T. Ozaki
Zeeman term in the OpenMx3.9 have problemUmar farooq49262020/02/12 19:33
by Umar farooq
Patch 3.9.2 to OpenMX Ver. 3.9T. Ozaki08142020/02/11 22:44
by T. Ozaki
NEGF convergence making loopVikash28612020/02/07 01:02
by T. Ozaki
Mailing list for the OpenMX ForumT. Ozaki07592020/02/06 23:09
by T. Ozaki
NEB simulationYuki Kamikawa27952020/01/30 21:00
by Yuki Kamikawa
NEB memory and parallel problemsReza68892020/01/29 00:41
by T. Ozaki
DosMain issue in metal-graphene heterostructures Samuel Dechamps17922020/01/25 13:51
by T. Ozaki
cygwin_exception::open_stackdumpfile: Dumping stackmasood289512020/01/22 02:05
by masood
core dumped in the exchange coupling calculation (Jx) for Mn12 Po-Hao 210202020/01/20 16:07
by Asako Terasawa
LzSz only spin-orbit coupling in collinear spin calculation?Asako Terasawa711132020/01/19 22:41
by Alireza Baradaran
Error in compiling openmx3.9Xiaoxiong224362020/01/18 16:31
by Xiaoxiong
Cannot finish the NEGF testrunK. Yamaguchi411822020/01/18 12:34
by T. Ozaki
error installation in openmx3.9Alireza Baradaran18032020/01/18 00:30
by Alireza Baradaran
Problem with jx in ver 3.9.1Zsolt510012020/01/17 11:29
by Asako Terasawa
Bad convergence for calculations with an electric field Chen17662020/01/16 13:35
by Po-Hao
NEGF zgetrf failed errormasood07092020/01/14 03:56
by masood
Error in installing openmx with intel mpi compiler and mkl Chen516592020/01/13 18:07
by Chen
NEGF Convergence problemVikash410012020/01/09 18:53
by Vikash
The convergence of RFC5Alisa18012020/01/02 15:51
by T. Ozaki
Patch 3.9.1 to OpenMX Ver. 3.9T. Ozaki07442020/01/02 15:40
by T. Ozaki

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