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Any plans on OpenMX 4.0?Weixiao Ji24732022/09/21 09:59
by Weixiao Ji
Type mismatch error at line 985 while installing 'makefile' of openmx3.8 with Kali linux terminalMD NILOY KHAN52882022/09/20 16:37
by Naoya Yamaguchi
Sizes of Hamiltonian and Overlap matrices in OpenMXWenfei54402022/09/15 18:38
by T. Ozaki
Non-Collinear DFT Euler AnglesMax Fusté Costa22942022/09/14 22:51
by T. Ozaki
How to calculate Local DOS (not PDOS)IK24512022/09/14 22:47
by T. Ozaki
installation error:config-f90.hmahendra63402022/09/04 23:15
by mahendra
GPU vs. CPUMehdi Vejdanihemmat26242022/08/26 16:18
by Mehdi Vejdanihemmat
Crystal structure with a moleculeELIE ALBERT73542022/08/26 10:58
by ELIE ALBERT
Spin Matrix ElementsJoel13042022/08/25 16:09
by T. Ozaki
SiC polymorphic DOS does not match with VASPIK14122022/08/24 14:11
by T. Ozaki
Problem with Jx calculationHemant Arora13542022/08/22 21:11
by Naoya Yamaguchi
About Onsite and Intersite interactions of DFT+U Yosua 23332022/08/16 10:52
by Yosua
Disagreement between bandgaps in band dispersion and DOSELIE ALBERT62942022/08/13 04:16
by ELIE ALBERT
Forces with core-holePavel Ondracka12732022/08/10 18:23
by T. Ozaki
STM image - energy window Michele Amato23642022/08/04 22:39
by Michele Amato
Error in DOS CalculationVipin104012022/07/30 10:01
by T. Ozaki
Band dispersion of the narrow-bandgap semiconductor black phosphorusHiroaki Tanaka43972022/07/29 22:14
by Hiroaki Tanaka
Energy levels of a moleculeELIE ALBERT22992022/07/29 21:30
by ELIE ALBERT
esp and scale factorsMehdi Vejdanihemmat22872022/07/26 15:42
by Mehdi Vejdanihemmat
Transport calculation of Fe|MgO|FeWuzhang Fang13682022/07/26 14:14
by T. Ozaki
thermal stability with openmxzeinab_mrd33592022/07/25 19:08
by Yung-Ting Lee
make espMehdi Vejdanihemmat103962022/07/24 07:03
by Mehdi Vejdanihemmat
band structure and DOSELIE ALBERT24332022/07/24 00:05
by ELIE ALBERT
Questions about Definitioin.of.Atomic.SpeciesJunyoung22912022/07/22 14:53
by Junyoung
Overlap integrals of two atomic orbitalsZhufeng Hou12682022/07/22 03:55
by Naoya Yamaguchi
About the improvement in scf-convergence.Takuma Takeda46312022/06/30 21:43
by Takuma Takeda
Format of HS.out FileKieran169082022/06/20 19:22
by T. Ozaki
Evaluation of Kerker factor.Takuma Takeda13572022/06/20 19:04
by T. Ozaki
calcularion of LDOSmaedeh53632022/06/20 17:01
by T. Ozaki
NEGF setupGurung14422022/06/16 12:54
by T. Ozaki
HOMO_LUMO_visualization_XcrysdenLina Bechohra15032022/06/16 12:46
by T. Ozaki
HOMO_LUMO keywords for periodic systems Lina Bechohra13952022/06/16 12:44
by T. Ozaki
Interface with Wannier90Wiwik15192022/06/16 12:42
by T. Ozaki
Van der Waals scf force converge problemAlbert 14412022/06/16 11:49
by T. Ozaki
Unfolded band structure spectral weightsArtem Pi14382022/06/16 10:16
by T. Ozaki
Building OpenMX latest with IntelGrigory Shamov13472022/06/16 10:04
by T. Ozaki
formation energy of Si diamond is not consistent with VASPIK15292022/06/16 09:59
by T. Ozaki
Relationship between the data in the PAO file and the orbital specified in OpenMXIK13422022/06/16 09:47
by T. Ozaki
Hubbard UMehdi Vejdanihemmat24552022/05/18 16:12
by Mehdi Vejdanihemmat
overlap between k1 and k2Wei Li205302022/05/16 15:48
by Naoya Yamaguchi
Segmentation fault in NEB calculationsLovleen Kaur33632022/05/13 19:17
by Naoya Yamaguchi
Bandgap issueWei Li34862022/05/08 20:23
by Naoya Yamaguchi
Overlap matrix between different group of atomsWei Li297612022/05/05 21:10
by Dongyu Liu
Bandgap underestimation problem-bulk TeMaedeh24112022/04/30 00:24
by Maedeh
Error in the LDA+U settingKieran14402022/04/27 12:16
by Naoya Yamaguchi
H and S at specific KpointWei Li23732022/04/20 21:05
by Wei Li
MacOS installation error, OpenMX-3.9Thomas Auckland66702022/04/20 20:16
by Takeru Nakashima
OpenMX 3.9 installation errorS. Matsushima77812022/04/14 22:12
by S. Matsushima
PDOS calculation with Spin-orbit Coupling Michele Amato15342022/04/08 20:18
by Naoya Yamaguchi
WSL installation error of OpenMX3.9Lingzhi Zhang26132022/04/06 11:01
by Lingzhi Zhang

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