OpenMX Forum
New Thread | Return Home | Mailing List | Points of Concern | Search | Past Log | Administration    

List of Threads

Topics Author Replies Views Last Modified
Another possible erratic problem in the Forcetest for F2_GGA.dat and GaAs_LDA.datKylin819332017/03/10 15:55
by T. Ozaki
OMXToolNaoya Yamaguchi119932017/03/10 00:03
by T. Ozaki
VPS and PAO gridsDaniil116622017/03/09 23:38
by T. Ozaki
cuda patchamer215172017/03/09 02:55
by amer
Patch 3.8.3 to OpenMX Ver. 3.8T. Ozaki013712017/03/08 15:01
by T. Ozaki
transmission(bias window)ebrahim117372017/03/08 11:28
by T. Ozaki
openmx-hksArtem Pulkin121242017/03/08 11:09
by T. Ozaki
Japanese manual of the OpenMX Ver. 3.8T. Ozaki014662017/03/08 01:27
by T. Ozaki
Spin density and charge transferAsad216382017/03/04 04:48
by Asad
openmx-3.8.1 and the latest ELPAmarcindulak120372017/03/02 22:49
by T. Ozaki
Patch 3.8.2 to OpenMX Ver. 3.8T. Ozaki015762017/03/02 22:40
by T. Ozaki
OpenMX 3.8 compiling errorShinya Tsukamoto318972017/03/02 22:38
by T. Ozaki
Berry phase calculation failureJohn Sham118682017/03/02 22:34
by T. Ozaki
convergence-graphene sheetDeniz418192017/03/02 21:43
by T. Ozaki
DFT-D3 for grapheneS Dechamps122472017/03/02 14:51
by T. Ozaki
Open Coredch217012017/03/02 13:51
by T. Ozaki
non-collinear anglesRoman Borovic120232017/03/02 11:53
by T. Ozaki
For parallel compile "make -j"Atsushi M. Ito116512017/03/02 11:46
by T. Ozaki
Variable cell optimization with external pressureLe The Anh117162017/03/02 10:24
by T. Ozaki
MD.Opt.EveryDIISamer118412017/02/26 13:20
by Naoya Yamaguchi
Spin polarization versus bias voltage Fronquer015022017/02/22 19:50
by Fronquer
negf-vcrelaxhamed615782017/01/27 20:55
by Artem Pulkin
drPeter Brodnicki114192017/01/21 01:56
by Artem Pulkin
SCF not converged in Non-linear DFT calculationXiaoqing Liang014892017/01/19 07:25
by Xiaoqing Liang
convergenceamir014322017/01/18 04:48
by amir
found an overcomplete basis setJohn Sham014992017/01/10 12:06
by John Sham
Bulk TransmissionDavid218692017/01/07 10:49
by David
Convergence of NEGF in heterostructure S Dechamps621412017/01/05 20:16
by S Dechamps
What is the unit for Kohn-Sham potential in the output file *.vhart.cube and *.v0.cubechen114782017/01/03 18:01
by Artem Pulkin
charge,spin (current densities)Pavan choudary120132016/12/26 21:55
by Mitsuaki Kawamura
IV curve GrapheneMia 121842016/12/26 17:55
by T. Ozaki
crystallographic directionsJulio Aguiar114792016/12/26 17:32
by T. Ozaki
about MAELuca 116772016/12/26 17:26
by T. Ozaki
ErrorSaeid Amjadian013922016/11/20 12:37
by Saeid Amjadian
Non-equlibriumAdalicia115672016/11/18 18:30
by Artem Pulkin
Initial Charge DensitiesClarke930732016/11/15 15:29
by Clarke
Convergence of NEGF for defective GNRsS Dechamps623782016/11/10 20:07
by S Dechamps
how to match the DOS of NEGF with The transmission Pavan choudary316562016/11/09 17:28
by Pavan choudary
Patch 3.8.1 to OpenMX Ver. 3.8T. Ozaki014972016/10/21 15:50
by T. Ozaki
Manual setting of occupation numbersJan-Niclas821312016/10/20 17:22
by T. Ozaki
Implementation of EDM using the continued fraction representation of Fermi functionAri Ojanperä117082016/10/18 00:07
by T. Ozaki
Problem about Mulliken population analysisduan218222016/10/16 23:12
by T. Ozaki
Analysis of NEGF resultsRohit215892016/10/16 22:31
by TO
PAOs for anionsDaniil116052016/10/16 22:09
by T. Ozaki
DIIS geometry optimizationNikhil218672016/10/16 21:55
by T. Ozaki
Bychkov-Rashba effect is dependent on the relative position of the system in the cell Dubois S.217532016/10/16 21:45
by T. Ozaki
alignment of band structure with vaccum levelRenato Borges Pontes216622016/10/16 19:03
by T. Ozaki
magnetic anisotropy energy calculated seems wrong!Shekoufe Khosravi218592016/10/16 19:01
by T. Ozaki
error on make TranMain with Ubuntu 14.04 LTSDiego016612016/10/05 07:00
by Diego
error on make DosMain with Ubuntu 14.04 LTSDiego016902016/10/05 06:57
by Diego

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17] [18] [19] [20] [21] [22] [23] [24] [25] [26] [27] [28] [29] [30] [31] [32] [33]


Open Thread    Locked Thread    Alarm(More than 900 replies)   Message from Administrator


- Web Patio -