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

List of Threads

Topics Author Replies Views Last Modified
From AdministratorTaisuke Ozaki053652005/01/09 05:33
by Taisuke Ozaki
What are the two major effects of the 115*1*22 cutting disc tool?yang huimin012018/11/17 16:28
by yang huimin
The problems of constrained optimization with EFxm3332018/11/13 13:57
by Naoya Yamaguchi
cialis online ndrfzjAnymnhqnfhbunse062018/11/13 07:11
by nfhbunse
What are the operational problems of the 4 1/2 super thin cutting disc?yang huimin0102018/11/12 11:53
by yang huimin
How to write Band.KPath.UnitCellWeiqi Li0322018/11/08 18:12
by Weiqi Li
No band structureWeiqi Li0322018/11/08 17:27
by Weiqi Li
The problem about NEGF calculationWeiqi Li4552018/11/08 17:03
by Weiqi Li
PAO questionWeiqi Li1322018/11/07 18:22
by Weiqi Li
JRCAT 244p and JAIST 2122pJ. Chapman0502018/10/18 19:59
by J. Chapman
projected direction in pdosMaedeh0442018/10/18 02:20
by Maedeh
transition probability calculation for metal cluster (rare metal)Manabu Inukai2512018/10/17 14:48
by Manabu Inukai
Electric field perpendicular to 2D materialssabike1822018/10/13 00:54
by Po-Hao
convergence of optimizationsabike2872018/10/11 23:07
by sabike
How to calculate charge density and deformation charge density with openmxxm0542018/10/11 09:17
by xm
compilation error: openmx 3.8Renato 111242018/10/11 02:35
by Renato
planar-averaged electrostatic potential Po-Hao5932018/10/09 12:00
by Naoya Yamaguchi
Transport direction in 2D slab NEGF calculationZHOU Jiaqi0692018/09/28 14:59
by ZHOU Jiaqi
transport direction for thin filmPrashant42412018/09/14 12:57
by Prashant
Vacancy study with OpenMxSamuel Dechamps1962018/09/13 13:00
by Naoya Yamaguchi
Patches to apply to build OpenMX with clangYuri0662018/09/11 11:19
by Yuri
NEGF vs Surface Green's function calculationEike F. Schwier01042018/09/06 12:44
by Eike F. Schwier
A question on vdW parameter ‘DFTD.IntDirection'ZHOU Jiaqi1802018/08/30 22:16
by T. Ozaki
errors in Indium PAO file?Tomonori Tanaka21472018/08/15 07:27
by Tomonori Tanaka
OpenMX Exchange coupling parameter: J per each orbitalJ.S.Feng22042018/08/14 12:02
by Hongkee Yoon
NEGF with gate voltage for molecular junctionsDongzhe Li11462018/08/07 17:33
by T. Ozaki
Fermi level dependence on basis setDechamps Samuel31662018/08/07 17:18
by T. Ozaki
work function with ESM modeljiang51902018/08/03 04:14
by jiang
Different total energy: X and Z periodicity tested with 1D carbon-chainDongzhe Li21312018/07/20 14:20
by Dongzhe Li
ERROR key=MD.Type The number of threads in each node for OpenMP parallelization is 1hashem.sina21292018/07/20 11:26
by Mitsuaki Kawamura
ERROR: PAOs of lead atoms can overlap only to the next nearest region.M.Sh21182018/07/20 08:10
by M.Sh
input files for periodic system under zero biasFrank31802018/07/15 12:00
by Frank
Unit in the exchange coupling calculationPui-Wai Ma11222018/07/11 05:28
by Pui-Wai Ma
convergence for ESM calculation with on2+EFjiang41752018/06/27 06:24
by jiang
error in make allsara.shafaei11512018/06/20 01:26
by Naoya Yamaguchi
calculations of Z2 and Chern numberWenliang Liu12202018/06/16 12:03
by T. Ozaki
Geometry optimization of metal slab yields nan forcesDechamps Samuel92292018/06/12 23:39
by Dechamps Samuel
How to solve this problem:APPLICATION TERMINATED WITH THE EXIT STRING: Killed (signal 9)xmzhang13432018/06/12 10:12
by T. Ozaki
Patch 3.8.5 to OpenMX Ver. 3.8T. Ozaki01982018/06/12 10:05
by T. Ozaki
a bad relaxed structure from the RFC5 geometry optimizaitonJack21442018/06/05 09:18
by Jack
Work Function of grapheneRenato22022018/05/26 00:02
by Renato
How to plot Vhart in a given direction.Carlos21502018/05/23 03:16
by Carlos
Step3 of Transport Calculation is not successfulMobin52052018/05/22 02:04
by Naoya Yamaguchi
Error in installationM.S22102018/05/21 23:41
by M.S
Can it be calculated across a node? That is, cluster testing xuanlv01182018/05/10 10:17
by xuanlv
Running the example of Cr2_CNC.dat program is reporting errorslucky61902018/05/09 20:46
by lucky
phononic spectraRiemann01892018/05/08 16:29
by Riemann
How to determine the Euler angle in Atoms.SpeciesAndCoordinateslucky71892018/05/05 18:02
by lucky
Absolute eigenvalue's index in conjunction with Absolute eigenvalue and Chemical PotentialRiemann11592018/05/02 00:59
by Naoya Yamaguchi
add_gcube.cRiemann51642018/05/01 16:48
by Riemann

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17] [18] [19] [20]


Open Thread    Locked Thread    Alarm(More than 90 replies)   Message from Administrator


- Web Patio -