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Topics Author Replies Views Last Modified
Convergence of NEGF for defective GNRsS Dechamps614732016/11/10 20:07
by S Dechamps
how to match the DOS of NEGF with The transmission Pavan choudary39302016/11/09 17:28
by Pavan choudary
Patch 3.8.1 to OpenMX Ver. 3.8T. Ozaki08752016/10/21 15:50
by T. Ozaki
Manual setting of occupation numbersJan-Niclas812662016/10/20 17:22
by T. Ozaki
Implementation of EDM using the continued fraction representation of Fermi functionAri Ojanperä19682016/10/18 00:07
by T. Ozaki
Problem about Mulliken population analysisduan211512016/10/16 23:12
by T. Ozaki
Analysis of NEGF resultsRohit29202016/10/16 22:31
by TO
PAOs for anionsDaniil19312016/10/16 22:09
by T. Ozaki
DIIS geometry optimizationNikhil211172016/10/16 21:55
by T. Ozaki
Bychkov-Rashba effect is dependent on the relative position of the system in the cell Dubois S.210902016/10/16 21:45
by T. Ozaki
alignment of band structure with vaccum levelRenato Borges Pontes29012016/10/16 19:03
by T. Ozaki
magnetic anisotropy energy calculated seems wrong!Shekoufe Khosravi210632016/10/16 19:01
by T. Ozaki
error on make TranMain with Ubuntu 14.04 LTSDiego010162016/10/05 07:00
by Diego
error on make DosMain with Ubuntu 14.04 LTSDiego09872016/10/05 06:57
by Diego
How Generate TranMain and DosMain package on OpenMX on Ubuntu 14.04 LTS?Diego Castillo V.08952016/10/04 03:27
by Diego Castillo V.
NEGF Calculation HangingPeter29392016/10/03 20:21
by Peter
Installation Manual of OpenMX 3.7.6-1 on Linux (Ubuntu 14.04 LTS)Diego Castillo024692016/09/29 03:25
by Diego Castillo
Installation Problem OpenMX 3.7Diego Castillo210992016/09/29 02:59
by Diego Castillo
Convergence Issue: Very High Value of UeleNikhil212632016/09/22 13:40
by Nikhil
installation error 3.8pavan choudary08182016/09/20 16:58
by pavan choudary
Installation 3.8Krishna210632016/09/10 19:06
by Krishna
Exchange coupling parameter program (jx)Joao Amaral618392016/09/06 16:58
by Hongkee Yoon
Error points in Band Structure of SrVO3Priya Dey110832016/09/04 21:05
by T. Ozaki
MBJLDASehoon Oh111082016/09/02 12:06
by T. Ozaki
Can openMX simulate few layer grapheneJohn Chen110252016/08/30 18:15
by Artem Pulkin
the question of bandgap and covalent bond John Chen411282016/08/30 17:18
by John Chen
Question about setting up angles in non-collinear DFTHung-Yu Yang18582016/08/30 16:30
by T. Ozaki
scf band calculations for different number of layersRohit39132016/08/29 14:39
by T. Ozaki
openmx3.7 errorzahra113592016/08/25 23:10
by Riemann
openmx3.8 errorzahra09882016/08/25 21:38
by zahra
There is a rigid shift toward negative energy in the band structure of MoS2 monolayerNadia Salami111002016/08/22 12:50
by T. Ozaki
Release of OpenMX Viewer Ver. 1.0T. Ozaki012782016/08/20 01:34
by T. Ozaki
Projected band structureRiemann624912016/08/19 15:45
by Riemann
Projected Bandstructure with Unfolding MethodRiemann617522016/08/17 03:44
by Riemann
Error in making DosMainsaeid amjadian09092016/08/12 21:42
by saeid amjadian
question regarding to plot up-spin and down-spin bands in noncollinear DFT calculationsNadia Salami111312016/08/12 18:36
by T. Ozaki
STM by WSXMLida316832016/08/11 22:01
by T. Ozaki
Software for Density of state files ?Rohit18892016/08/10 16:01
by T. Ozaki
OpenMX3.8 installation problemYohei Ibe212552016/08/05 11:24
by Yohei Ibe
converting band file to GNUBAND,BANDDAT1 fileRG311512016/08/03 15:08
by T. Ozaki
version of intel compilerSung19462016/08/03 13:31
by T. Ozaki
Reduce timing of NEGF for AlHiroya Nakata110832016/08/02 17:15
by Artem Pulkin
problems with plotting the band structure.Rohit Goel112472016/07/29 16:23
by Rohit Goel
Band unfolding for supercells with additional atomsNikolai Zaitsev211622016/07/28 21:25
by Nikolai Zaitsev
Error in NEGFKeshav Raheja211812016/07/28 02:00
by Keshav Raheja
Incomplete NEGF run with correct transmission vs energy resultVipin Kumar313102016/07/26 19:42
by Artem Pulkin
Band Structure of Black phosphorousRohit Goel210652016/07/22 11:59
by Rohit Goel
PAOs of lead atoms can overlap only to the next nearest regionVipin Kumar1013532016/07/18 20:18
by Vipin Kumar
Do the molecular orbitals obtained by openmx include the factor exp(ikr)?Xiangyang Peng25152016/07/14 18:25
by Xiangyang Peng
Phosphorene Real Space HmiltonianRiemann313762016/07/11 22:11
by Artem Pulkin

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