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Bandstructure within energy rangeAnshu Gaur13192022/11/01 23:37
by T. Ozaki
Finished: Mentainance of the OpenMX websiteT. Ozaki03092022/10/31 01:15
by T. Ozaki
Error in MLWF calculated :rejectedAdantion25062022/10/21 13:54
by Adantion
About Fermi level and magnetic moment in MnBi2Te4ooteki45472022/10/21 13:04
by Oo Teki
How can I calculate the whole band dispersion in the Brillouin zone?Junyoung83832022/10/20 16:45
by Junyoung
Point group of a k-pointAlireza Baradaran13362022/10/20 14:59
by T. Ozaki
How to find interaction energy in result with using DFT-D3 methodAdantion13382022/10/20 14:57
by T. Ozaki
Z2 invariant calculationAlireza Baradaran54812022/10/19 15:10
by Naoya Yamaguchi
DOS Gaussian smearing Michele Amato24452022/10/13 01:00
by Michele Amato
Survey on the use of simulation codesT. Ozaki03642022/09/27 09:23
by T. Ozaki
Any plans on OpenMX 4.0?Weixiao Ji25562022/09/21 09:59
by Weixiao Ji
Type mismatch error at line 985 while installing 'makefile' of openmx3.8 with Kali linux terminalMD NILOY KHAN53862022/09/20 16:37
by Naoya Yamaguchi
Sizes of Hamiltonian and Overlap matrices in OpenMXWenfei55772022/09/15 18:38
by T. Ozaki
Non-Collinear DFT Euler AnglesMax Fusté Costa23572022/09/14 22:51
by T. Ozaki
How to calculate Local DOS (not PDOS)IK26322022/09/14 22:47
by T. Ozaki
installation error:config-f90.hmahendra64802022/09/04 23:15
by mahendra
GPU vs. CPUMehdi Vejdanihemmat28062022/08/26 16:18
by Mehdi Vejdanihemmat
Crystal structure with a moleculeELIE ALBERT74722022/08/26 10:58
by ELIE ALBERT
Spin Matrix ElementsJoel13712022/08/25 16:09
by T. Ozaki
SiC polymorphic DOS does not match with VASPIK14992022/08/24 14:11
by T. Ozaki
Problem with Jx calculationHemant Arora14232022/08/22 21:11
by Naoya Yamaguchi
About Onsite and Intersite interactions of DFT+U Yosua 24102022/08/16 10:52
by Yosua
Disagreement between bandgaps in band dispersion and DOSELIE ALBERT63762022/08/13 04:16
by ELIE ALBERT
Forces with core-holePavel Ondracka13512022/08/10 18:23
by T. Ozaki
STM image - energy window Michele Amato24412022/08/04 22:39
by Michele Amato
Error in DOS CalculationVipin105042022/07/30 10:01
by T. Ozaki
Band dispersion of the narrow-bandgap semiconductor black phosphorusHiroaki Tanaka44692022/07/29 22:14
by Hiroaki Tanaka
Energy levels of a moleculeELIE ALBERT23712022/07/29 21:30
by ELIE ALBERT
esp and scale factorsMehdi Vejdanihemmat23592022/07/26 15:42
by Mehdi Vejdanihemmat
Transport calculation of Fe|MgO|FeWuzhang Fang14712022/07/26 14:14
by T. Ozaki
thermal stability with openmxzeinab_mrd34572022/07/25 19:08
by Yung-Ting Lee
make espMehdi Vejdanihemmat105442022/07/24 07:03
by Mehdi Vejdanihemmat
band structure and DOSELIE ALBERT25232022/07/24 00:05
by ELIE ALBERT
Questions about Definitioin.of.Atomic.SpeciesJunyoung23632022/07/22 14:53
by Junyoung
Overlap integrals of two atomic orbitalsZhufeng Hou13522022/07/22 03:55
by Naoya Yamaguchi
About the improvement in scf-convergence.Takuma Takeda48222022/06/30 21:43
by Takuma Takeda
Format of HS.out FileKieran1611302022/06/20 19:22
by T. Ozaki
Evaluation of Kerker factor.Takuma Takeda14672022/06/20 19:04
by T. Ozaki
calcularion of LDOSmaedeh54582022/06/20 17:01
by T. Ozaki
NEGF setupGurung15322022/06/16 12:54
by T. Ozaki
HOMO_LUMO_visualization_XcrysdenLina Bechohra15912022/06/16 12:46
by T. Ozaki
HOMO_LUMO keywords for periodic systems Lina Bechohra14632022/06/16 12:44
by T. Ozaki
Interface with Wannier90Wiwik16132022/06/16 12:42
by T. Ozaki
Van der Waals scf force converge problemAlbert 15452022/06/16 11:49
by T. Ozaki
Unfolded band structure spectral weightsArtem Pi15252022/06/16 10:16
by T. Ozaki
Building OpenMX latest with IntelGrigory Shamov14262022/06/16 10:04
by T. Ozaki
formation energy of Si diamond is not consistent with VASPIK16562022/06/16 09:59
by T. Ozaki
Relationship between the data in the PAO file and the orbital specified in OpenMXIK14182022/06/16 09:47
by T. Ozaki
Hubbard UMehdi Vejdanihemmat25722022/05/18 16:12
by Mehdi Vejdanihemmat
overlap between k1 and k2Wei Li206382022/05/16 15:48
by Naoya Yamaguchi

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