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

List of Threads

Topics Author Replies Views Last Modified
The patch (Ver.3.5.2) of OpenMX Ver. 3.5T.Ozaki013952011/08/30 15:06
by T.Ozaki
vps calculated by LDAwsajad215032011/08/28 17:36
by wsajad
Fermi level is not at the middle of the gapDinh Loc Duong489062011/08/26 17:43
by T.Ozaki
Enquiry with Band structureDimpy Sharma119992011/08/26 17:28
by T.Ozaki
Question about GGA+Urocdawn230972011/08/23 15:10
by wsajad
Atoms.UnitVectors.Unit wsajad116992011/08/22 03:34
by mahyar
constant magnetismGabriel Greene324922011/08/22 03:29
by mahyar
slow convergence of small clusterssanjeev220882011/08/11 03:15
by N.Kolchenko
problem in band dispersionwsajad013342011/08/08 21:06
by wsajad
where to set gamma poin in the input file?wsajad013892011/08/06 15:08
by wsajad
Long directory path for argument DATA.PATH in the input file causes OpenMX to segfaultRenato Miceli119752011/08/05 01:47
by T.Ozaki
Spherical Bessel TransformJulio Aguiar117272011/08/02 00:14
by T.Ozaki
out-put vizualisationsanjeev117442011/07/30 00:42
by T.Ozaki
Utotal is positive and high enoughwsajad119662011/07/30 00:37
by T.Ozaki
Unexisting input file causes TranMain to segfaultRenato Miceli115602011/07/30 00:35
by T.Ozaki
error in calculations of dos wsajad526412011/07/25 15:10
by wsajad
Use of symmetry in OpenmxMauro Sgroi220982011/07/22 22:46
by Mauro Sgroi
why Uele is zero in NEGF (step2)?arlonne214632011/07/12 15:21
by arlonne
whether we are calculating for bulk or nanowsajad420392011/07/11 21:16
by T.Ozaki
error in running wsajad216102011/07/11 16:14
by wsajad
Atoms.SpeciesAndCoordinatesJulio Aguiar116642011/07/06 00:46
by T.Ozaki
input file for the sfc calculations of PbMnTe & CdMnTeidris215362011/06/30 16:47
by idri
Geometry optimization and restart files in parallel (on many nodes)Mauro Sgroi735392011/06/21 19:25
by Mauro Sgroi
GPUDenis Music116982011/06/09 01:01
by T.Ozaki
DOS calculation by OpenMxSheelan SC943512011/06/08 19:35
by Sheelan SC
DOS and NEGFAlejandro Leon222742011/06/01 15:29
by Sheelan SC
performance against Siesta, any impression?David320712011/05/29 21:42
by T.Ozaki
Transmission lida115642011/05/28 10:05
by T.Ozaki
DZP equivalent basisDavid520622011/05/25 23:48
by T.Ozaki
Release of OpenMX Ver.3.5T.Ozaki539712011/05/22 04:13
by David
question on MLWF in Noncolinear calculationjchang119812011/05/21 00:36
by T.Ozaki
Tight Binding parameter extract from MLWFKF132302011/05/20 23:27
by jchang
Bug in function Cluster_collinearRenato Miceli819452011/05/13 21:41
by Renato Miceli
OpenMX CDWole115342011/05/04 21:49
by T. Ozaki
Memory & new versionJan Rusz122822011/05/04 21:08
by T. Ozaki
Dr.SciKuznetsov114742011/05/04 20:22
by T. Ozaki
hamiltonian matrix and overlap filesxianghui425752011/04/06 22:51
by xianghui
Electric transport calculations: errorDr Haider Abbas016632011/03/28 16:14
by Dr Haider Abbas
New development of OpenMXMauro Sgroi217892011/03/10 04:29
by Mauro Sgroi
Include external fileJan Sommer013962011/03/04 00:47
by Jan Sommer
Assigning initial charges to atoms in an input fileDerek Stewart117562011/03/03 11:07
by T.Ozaki
Collection of Utilities/Tools to create input filesJan Sommer016732011/03/02 23:58
by Jan Sommer
A few questions about adpack 2.1G. Faccin122002011/02/01 22:06
by T.Ozaki
tight binding parameter extractionJ. Chang229322011/01/13 02:07
by J. Chang
Difference Charge DensityGabriel Greene124952010/12/10 09:40
by T.Ozaki
Re: Difference Charge densityGabriel Greene015022010/12/10 00:14
by Gabriel Greene
BFGS results change with number of processorsSarah Jones119102010/12/02 23:20
by T.Ozaki
Minor patch for bandgnu13.cH. Jeong119882010/11/29 21:46
by T.Ozaki
ESPGabriel Greene221522010/11/26 23:37
by Gabriel Greene
Transmission calculations with non-collinear spin DFTWendy222932010/11/25 05:32
by Wendy

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17] [18] [19] [20] [21] [22] [23]


Open Thread    Locked Thread    Alarm(More than 180 replies)   Message from Administrator


- Web Patio -