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Topics Author Replies Views Last Modified
Compile OpenMX v3.9.9 in windows using Msys2 or Mingw-w64Kylin05312022/11/18 12:26
by Kylin
Change direction of transmission in negf fileZeinab.mrd56102022/11/12 21:59
by zeinab.mrd
NEGF runtestMehdi Vejdanihemmat36432022/11/12 00:03
by Mehdi Vejdanihemmat
Interface with BoltzTraPWiwik1217552022/11/11 15:22
by Wiwik
kSpin in 3.9.9Naoya Yamaguchi16532022/11/11 11:42
by T. Ozaki
Ghost states_band structureAmina127582022/11/11 11:14
by T. Ozaki
Installation openmx3.9 error: with Ubuntu 22 + ifort 2020Shahram 48832022/11/10 03:04
by Shahram
shift in Kohn-Sham potential while calculating work functionRishabh Sharma26082022/11/08 21:43
by Rishabh Sharma
Band unfolding of heterojunctionXinliang Huang17012022/11/08 13:25
by Chi-Cheng Lee
core dumped in the exchange coupling calculation (Jx) for cluster systemHEMANT ARORA36862022/11/01 23:42
by T. Ozaki
Bandstructure within energy rangeAnshu Gaur15482022/11/01 23:37
by T. Ozaki
Finished: Mentainance of the OpenMX websiteT. Ozaki05062022/10/31 01:15
by T. Ozaki
Error in MLWF calculated :rejectedAdantion27892022/10/21 13:54
by Adantion
About Fermi level and magnetic moment in MnBi2Te4ooteki49782022/10/21 13:04
by Oo Teki
How can I calculate the whole band dispersion in the Brillouin zone?Junyoung86112022/10/20 16:45
by Junyoung
Point group of a k-pointAlireza Baradaran15552022/10/20 14:59
by T. Ozaki
How to find interaction energy in result with using DFT-D3 methodAdantion15652022/10/20 14:57
by T. Ozaki
Z2 invariant calculationAlireza Baradaran58792022/10/19 15:10
by Naoya Yamaguchi
DOS Gaussian smearing Michele Amato27322022/10/13 01:00
by Michele Amato
Survey on the use of simulation codesT. Ozaki06112022/09/27 09:23
by T. Ozaki
Any plans on OpenMX 4.0?Weixiao Ji28452022/09/21 09:59
by Weixiao Ji
Type mismatch error at line 985 while installing 'makefile' of openmx3.8 with Kali linux terminalMD NILOY KHAN56962022/09/20 16:37
by Naoya Yamaguchi
Sizes of Hamiltonian and Overlap matrices in OpenMXWenfei59572022/09/15 18:38
by T. Ozaki
Non-Collinear DFT Euler AnglesMax Fusté Costa26082022/09/14 22:51
by T. Ozaki
How to calculate Local DOS (not PDOS)IK210332022/09/14 22:47
by T. Ozaki
installation error:config-f90.hmahendra68062022/09/04 23:15
by mahendra
GPU vs. CPUMehdi Vejdanihemmat214792022/08/26 16:18
by Mehdi Vejdanihemmat
Crystal structure with a moleculeELIE ALBERT711742022/08/26 10:58
by ELIE ALBERT
Spin Matrix ElementsJoel16012022/08/25 16:09
by T. Ozaki
SiC polymorphic DOS does not match with VASPIK18572022/08/24 14:11
by T. Ozaki
Problem with Jx calculationHemant Arora17002022/08/22 21:11
by Naoya Yamaguchi
About Onsite and Intersite interactions of DFT+U Yosua 26592022/08/16 10:52
by Yosua
Disagreement between bandgaps in band dispersion and DOSELIE ALBERT66332022/08/13 04:16
by ELIE ALBERT
Forces with core-holePavel Ondracka15812022/08/10 18:23
by T. Ozaki
STM image - energy window Michele Amato27282022/08/04 22:39
by Michele Amato
Error in DOS CalculationVipin108492022/07/30 10:01
by T. Ozaki
Band dispersion of the narrow-bandgap semiconductor black phosphorusHiroaki Tanaka47012022/07/29 22:14
by Hiroaki Tanaka
Energy levels of a moleculeELIE ALBERT26672022/07/29 21:30
by ELIE ALBERT
esp and scale factorsMehdi Vejdanihemmat26242022/07/26 15:42
by Mehdi Vejdanihemmat
Transport calculation of Fe|MgO|FeWuzhang Fang111032022/07/26 14:14
by T. Ozaki
thermal stability with openmxzeinab_mrd37722022/07/25 19:08
by Yung-Ting Lee
make espMehdi Vejdanihemmat108392022/07/24 07:03
by Mehdi Vejdanihemmat
band structure and DOSELIE ALBERT29682022/07/24 00:05
by ELIE ALBERT
Questions about Definitioin.of.Atomic.SpeciesJunyoung26772022/07/22 14:53
by Junyoung
Overlap integrals of two atomic orbitalsZhufeng Hou16152022/07/22 03:55
by Naoya Yamaguchi
About the improvement in scf-convergence.Takuma Takeda415932022/06/30 21:43
by Takuma Takeda
Format of HS.out FileKieran1617302022/06/20 19:22
by T. Ozaki
Evaluation of Kerker factor.Takuma Takeda17702022/06/20 19:04
by T. Ozaki
calcularion of LDOSmaedeh57102022/06/20 17:01
by T. Ozaki
NEGF setupGurung17672022/06/16 12:54
by T. Ozaki

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