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Could not find ../DFT_DATA19/VPS/Gd_PBE19.vpsKylin39062022/01/09 00:42
by Naoya Yamaguchi
the band structure of 4H-SiCQi Wang59372022/01/08 02:12
by Naoya Yamaguchi
Outputting cube-file for specific Molecular OrbitalKelvin Anggara17172021/12/30 13:37
by Naoya Yamaguchi
eigen valuemaedeh38302021/12/28 20:28
by Naoya Yamaguchi
some questionszhou chao16512021/12/28 12:22
by Naoya Yamaguchi
band gap accuracyAli17592021/12/27 16:06
by Pavel Ondracka
OpenMx 3.9 installation issueGilad Gani811452021/12/23 18:45
by Gilad Gani
atmic stressK.Suzuki07012021/12/22 17:51
by K.Suzuki
Determination of atomic energy and stressS.Sato16782021/12/15 19:07
by Naoya Yamaguchi
How can we determine fermi level from HS.out and PAO/VPS informationPES217i18192021/12/14 11:55
by Naoya Yamaguchi
Inconsistent lattice Ana16662021/12/11 16:31
by Naoya Yamaguchi
Gate potentialSamuel Dechamps07052021/12/07 00:23
by Samuel Dechamps
Two questions about PDOS calculation of CoO.K.Usami310192021/12/05 00:21
by K.Usami
problem in OpenMX interface with BoltzTraP zeinab moradi912072021/11/26 10:58
by Masanobu Miyata
Openmx - BoltzTrap2Alejandro Leon17562021/11/26 10:52
by Masanobu Miyata
STM by WSxMVipin Kumar414402021/11/22 18:48
by Naoya Yamaguchi
Error Message from the Installation of OpenMXKieran911802021/11/20 13:49
by Naoya Yamaguchi
A trouble with generation of restart fileTakuma Takeda29952021/11/15 23:01
by Takuma Takeda
undefined reference to `Set_XC_NL1_Grid'Luca 210032021/11/15 22:53
by Luca
There is an error in the electron transport calculationZhipeng Huang79792021/11/09 17:03
by Zhipeng Huang
deb packages of OpenMXNaoya Yamaguchi28032021/11/08 17:36
by Naoya Yamaguchi
Linking fails with gcc 11.2.1 - multiple definition of many variablesPavel Ondracka075172021/11/08 16:31
by Pavel Ondracka
gcube2oned for a cube file including spaces in comment linesNaoya Yamaguchi07332021/11/08 00:11
by Naoya Yamaguchi
About obtaining PDOS by hybridized orbitalsTakuma Takeda210362021/11/07 20:10
by Takuma Takeda
openmx3.9 mpi errordavidshisui18242021/11/07 14:37
by Naoya Yamaguchi
Thermostat issues when simulating surface bombardmentPavel Ondračka06382021/11/04 23:26
by Pavel Ondračka
openmx on Debian BullseyeH.Ueda59272021/11/04 17:59
by H.Ueda
OpenMx3.9.9 install problem TSUTOMU HOSHINO19842021/11/04 01:20
by Naoya Yamaguchi
Some questions about MD.TimeStepZ27832021/10/30 18:59
by Z
calculation of hoppingmaedeh58862021/10/29 19:32
by maedeh
mpirun hangs indefinetly on multiple nodesP07172021/10/29 12:53
by P
The magnitude of the crystal field splittingK.Usami07132021/10/24 18:26
by K.Usami
On the model with shear strainS.Sato06592021/10/21 14:56
by S.Sato
Patch 3.9.3 to OpenMX Ver. 3.9T. Ozaki711532021/10/20 12:40
by Atsushi M. Ito
Energy decompositionJingyang Wang113142021/10/17 21:50
by T. Ozaki
How to put strain on a materialS.Sato17752021/10/15 11:53
by Naoya Yamaguchi
How to calculate eigenstates from HS.outPES217i611092021/10/06 14:44
by Naoya Yamaguchi
Able to make VPS with adpack (no segmentation fault)Malone08072021/09/23 22:52
by Malone
Restarting NEB calculation changes coordinate unitHisashi Higuchi37132021/09/23 12:31
by Hisashi Higuchi
Installation error openmx 3.9Vipin Kumar1324142021/09/22 21:07
by Naoya Yamaguchi
How to calculate the melting point of a compound using the MD simulations?Xuemei Zhang18832021/09/18 11:12
by T. Ozaki
Installation of OpenMX Ver. 3.9 on Ubuntu 18.04.4 LTS on WSL on Windows 10 (64bit)T. Ozaki148962021/08/29 10:52
by T. Ozaki
The result of runtestK. Yamaguchi410492021/08/23 09:12
by K. Yamaguchi
OpenMx-3.9 : segmentation fault at runtime with gcc-9Deepali Rai314942021/08/18 20:20
by Deepali Rai
Compilation advice on 5950x AMD RyzenZsolt112462021/08/15 10:44
by T. Ozaki
bug in patch3.9.4Jhon González39592021/08/15 10:39
by T. Ozaki
orbital order in HS.outRK110262021/08/12 19:40
by Naoya Yamaguchi
Problems with NH MD and multiple continuation runsPavel Ondracka39652021/08/08 06:40
by T. Ozaki
Instability of a function Band_DFT_NonCol in the case of GCCNaoya Yamaguchi18592021/08/07 12:06
by T. Ozaki
Problems with MD restart and rmm-diisvPavel Ondracka38302021/08/04 21:44
by T. Ozaki

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