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From AdministratorTaisuke Ozaki06072021/04/07 21:20
by Taisuke Ozaki
About calculating bulk system with coulomb cutoff methodTsubasa Hase1302022/09/21 22:08
by T. Ozaki
Any plans on OpenMX 4.0?Weixiao Ji2662022/09/21 09:59
by Weixiao Ji
Type mismatch error at line 985 while installing 'makefile' of openmx3.8 with Kali linux terminalMD NILOY KHAN5292022/09/20 16:37
by Naoya Yamaguchi
Sizes of Hamiltonian and Overlap matrices in OpenMXWenfei5972022/09/15 18:38
by T. Ozaki
Non-Collinear DFT Euler AnglesMax Fusté Costa2262022/09/14 22:51
by T. Ozaki
How to calculate Local DOS (not PDOS)IK2592022/09/14 22:47
by T. Ozaki
installation error:config-f90.hmahendra6482022/09/04 23:15
by mahendra
GPU vs. CPUMehdi Vejdanihemmat2782022/08/26 16:18
by Mehdi Vejdanihemmat
Crystal structure with a moleculeELIE ALBERT7582022/08/26 10:58
by ELIE ALBERT
Spin Matrix ElementsJoel1462022/08/25 16:09
by T. Ozaki
SiC polymorphic DOS does not match with VASPIK1672022/08/24 14:11
by T. Ozaki
Problem with Jx calculationHemant Arora1452022/08/22 21:11
by Naoya Yamaguchi
About Onsite and Intersite interactions of DFT+U Yosua 2682022/08/16 10:52
by Yosua
Disagreement between bandgaps in band dispersion and DOSELIE ALBERT6682022/08/13 04:16
by ELIE ALBERT
Forces with core-holePavel Ondracka1552022/08/10 18:23
by T. Ozaki
STM image - energy window Michele Amato2642022/08/04 22:39
by Michele Amato
Error in DOS CalculationVipin101182022/07/30 10:01
by T. Ozaki
Band dispersion of the narrow-bandgap semiconductor black phosphorusHiroaki Tanaka41222022/07/29 22:14
by Hiroaki Tanaka
Energy levels of a moleculeELIE ALBERT2492022/07/29 21:30
by ELIE ALBERT
esp and scale factorsMehdi Vejdanihemmat2662022/07/26 15:42
by Mehdi Vejdanihemmat
Transport calculation of Fe|MgO|FeWuzhang Fang1892022/07/26 14:14
by T. Ozaki
thermal stability with openmxzeinab_mrd31032022/07/25 19:08
by Yung-Ting Lee
make espMehdi Vejdanihemmat101142022/07/24 07:03
by Mehdi Vejdanihemmat
band structure and DOSELIE ALBERT2642022/07/24 00:05
by ELIE ALBERT
Questions about Definitioin.of.Atomic.SpeciesJunyoung2802022/07/22 14:53
by Junyoung
Overlap integrals of two atomic orbitalsZhufeng Hou1632022/07/22 03:55
by Naoya Yamaguchi
About the improvement in scf-convergence.Takuma Takeda41512022/06/30 21:43
by Takuma Takeda
Format of HS.out FileKieran163212022/06/20 19:22
by T. Ozaki
Evaluation of Kerker factor.Takuma Takeda1632022/06/20 19:04
by T. Ozaki
calcularion of LDOSmaedeh5902022/06/20 17:01
by T. Ozaki
NEGF setupGurung11492022/06/16 12:54
by T. Ozaki
HOMO_LUMO_visualization_XcrysdenLina Bechohra11572022/06/16 12:46
by T. Ozaki
HOMO_LUMO keywords for periodic systems Lina Bechohra11282022/06/16 12:44
by T. Ozaki
Interface with Wannier90Wiwik11562022/06/16 12:42
by T. Ozaki
Van der Waals scf force converge problemAlbert 11212022/06/16 11:49
by T. Ozaki
Unfolded band structure spectral weightsArtem Pi11192022/06/16 10:16
by T. Ozaki
Building OpenMX latest with IntelGrigory Shamov1812022/06/16 10:04
by T. Ozaki
formation energy of Si diamond is not consistent with VASPIK11122022/06/16 09:59
by T. Ozaki
Relationship between the data in the PAO file and the orbital specified in OpenMXIK1862022/06/16 09:47
by T. Ozaki
error in visualize the STM image by WSxM 4.0 Beta 9.3 and WSxM 5.0 Develop 10.2zeinab.mrd1822022/06/16 09:45
by T. Ozaki
Hubbard UMehdi Vejdanihemmat21192022/05/18 16:12
by Mehdi Vejdanihemmat
overlap between k1 and k2Wei Li201872022/05/16 15:48
by Naoya Yamaguchi
Segmentation fault in NEB calculationsLovleen Kaur3902022/05/13 19:17
by Naoya Yamaguchi
Bandgap issueWei Li31452022/05/08 20:23
by Naoya Yamaguchi
Overlap matrix between different group of atomsWei Li292952022/05/05 21:10
by Dongyu Liu
Bandgap underestimation problem-bulk TeMaedeh21122022/04/30 00:24
by Maedeh
Error in the LDA+U settingKieran11042022/04/27 12:16
by Naoya Yamaguchi
H and S at specific KpointWei Li21292022/04/20 21:05
by Wei Li
MacOS installation error, OpenMX-3.9Thomas Auckland61902022/04/20 20:16
by Takeru Nakashima

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