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From AdministratorTaisuke Ozaki05372021/04/07 21:20
by Taisuke Ozaki
Band dispersion of the narrow-bandgap semiconductor black phosphorusHiroaki Tanaka062022/07/04 20:45
by Hiroaki Tanaka
About the improvement in scf-convergence.Takuma Takeda4662022/06/30 21:43
by Takuma Takeda
Format of HS.out FileKieran162352022/06/20 19:22
by T. Ozaki
Evaluation of Kerker factor.Takuma Takeda1222022/06/20 19:04
by T. Ozaki
calcularion of LDOSmaedeh5382022/06/20 17:01
by T. Ozaki
NEGF setupGurung1952022/06/16 12:54
by T. Ozaki
HOMO_LUMO_visualization_XcrysdenLina Bechohra11062022/06/16 12:46
by T. Ozaki
HOMO_LUMO keywords for periodic systems Lina Bechohra1862022/06/16 12:44
by T. Ozaki
Interface with Wannier90Wiwik11022022/06/16 12:42
by T. Ozaki
Van der Waals scf force converge problemAlbert 1702022/06/16 11:49
by T. Ozaki
Unfolded band structure spectral weightsArtem Pi1732022/06/16 10:16
by T. Ozaki
Building OpenMX latest with IntelGrigory Shamov1312022/06/16 10:04
by T. Ozaki
formation energy of Si diamond is not consistent with VASPIK1522022/06/16 09:59
by T. Ozaki
Relationship between the data in the PAO file and the orbital specified in OpenMXIK1392022/06/16 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.mrd1402022/06/16 09:45
by T. Ozaki
Hubbard UMehdi Vejdanihemmat2662022/05/18 16:12
by Mehdi Vejdanihemmat
overlap between k1 and k2Wei Li201382022/05/16 15:48
by Naoya Yamaguchi
Segmentation fault in NEB calculationsLovleen Kaur3492022/05/13 19:17
by Naoya Yamaguchi
Bandgap issueWei Li3982022/05/08 20:23
by Naoya Yamaguchi
Overlap matrix between different group of atomsWei Li292372022/05/05 21:10
by Dongyu Liu
Bandgap underestimation problem-bulk TeMaedeh2702022/04/30 00:24
by Maedeh
Error in the LDA+U settingKieran1612022/04/27 12:16
by Naoya Yamaguchi
H and S at specific KpointWei Li2922022/04/20 21:05
by Wei Li
MacOS installation error, OpenMX-3.9Thomas Auckland61472022/04/20 20:16
by Takeru Nakashima
OpenMX 3.9 installation errorS. Matsushima71652022/04/14 22:12
by S. Matsushima
PDOS calculation with Spin-orbit Coupling Michele Amato11142022/04/08 20:18
by Naoya Yamaguchi
WSL installation error of OpenMX3.9Lingzhi Zhang21252022/04/06 11:01
by Lingzhi Zhang
Kerker factorMehdi Vejdanihemmat2812022/04/03 00:54
by Mehdi Vejdanihemmat
problem in DOS calculationmaedeh11302022/04/02 21:07
by Mehdi Vejdanihemmat
overlap and Hamiltonian matrix elements in the MLWF basisWei Li1802022/04/01 12:20
by Naoya Yamaguchi
Check symmetry breaking under influence of SOI and/or electric chargeBagus21082022/03/27 22:15
by Bagus
Problem contains processor column with zero widthWei Li2862022/03/20 03:46
by Wei Li
non collinear variable cell relaxation Gurung0832022/03/04 15:41
by Gurung
Error code in running GGA-PBE+UVipin Kumar11072022/03/01 12:48
by Naoya Yamaguchi
Parameters for running large systemsMChen42502022/02/28 14:09
by Gurung
Format of <seedname>.Band File and Spin Texture CalculationKieran212832022/02/26 13:23
by Naoya Yamaguchi
non collinear calculations in openmxGurung31152022/02/26 12:34
by Gurung
About the dipole moment in SrTiO3Gurung21072022/02/24 01:10
by Gurung
Incorrect Bloch phase factor?Malone31252022/02/22 09:01
by Malone
kSpin gives incorrect eigenvaluesShunsuke Yoshizawa21042022/02/18 19:14
by Shunsuke Yoshizawa
Segmentation fault (core dumped)Vipin Kumar01092022/02/17 19:30
by Vipin Kumar
Problem with unfolding the band structure of 9x9 supercellArtem Tarasov31172022/02/14 18:38
by Naoya Yamaguchi
spin orbit interaction Ali11192022/02/10 05:52
by Ali
optimization problem for amorphous SiO2 greenishfu01012022/02/08 01:47
by greenishfu
band structurereza majidinia01232022/02/04 16:47
by reza majidinia
scf.EigenvalueSolver tag in input filePavel Chirkov1972022/01/30 17:28
by Naoya Yamaguchi
OPENMX 3.9 : Error Installation Arif Lukmantoro22162022/01/26 17:48
by Arif Lukmantoro
How to reduce memory usage for very large systems?Chong Wang41542022/01/25 12:29
by Naoya Yamaguchi
Problems in structure optimization of a slab systemHiroaki Tanaka31292022/01/21 12:37
by Hiroaki Tanaka

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