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Topics Author Replies Views Last Modified
SCF problem!Javan1177652013/09/25 04:45
by JAVAN
problems on the geometry optimization of grapheneyugd373522013/09/18 08:51
by yugd
relation between scf.energycutoff and scf.Ngriddchrobak189872013/09/17 23:10
by T. Ozaki
my first impression of openmxyugd188942013/09/17 22:41
by T. Ozaki
Fock MatrixRuibin Liu117502013/09/17 22:32
by T. Ozaki
about scf.system.chargeN.Kolchenko113312013/09/05 05:08
by N.Kolchenko
Solutions for installation of OpenMX3.7 with MKL in linux64Daniel Coimbra852682013/09/04 14:06
by Somesh Bhattacharya
openmx3.7 installation on Cygwin?K. Kachrimanis931752013/09/03 11:47
by T.V.T. Duy
Patch 3.7.6 to OpenMX Ver. 3.7T. Ozaki017692013/09/01 14:47
by T. Ozaki
How to print out derivatives of individual H and S matrix elementsLK114752013/08/30 17:51
by T. Ozaki
Patch 3.7.5 to OpenMX Ver. 3.7T. Ozaki018842013/08/29 17:53
by T. Ozaki
openmx3.7Gary Washington115502013/08/23 21:52
by T. Ozaki
Difference in total energy between version 3.6 and 3.7Bob Schoeters220032013/08/02 16:53
by Bob Schoeters
Calculate energy with constrained magnitude of magnetic momentPui-Wai Ma115572013/08/01 22:28
by T. Ozaki
Non-local potential EXcluded from vo.cube and v1.cube: why? Leonardo Makinistian219862013/07/26 18:43
by Leonardo Makinistian
Patch 3.7.4 to OpenMX Ver. 3.7T. Ozaki219572013/07/26 13:23
by T. Ozaki
OPENMX 3.7 Installation problemKanagaraj C845592013/07/16 15:57
by Kanagaraj C
LCAOzahra115172013/07/11 17:48
by T. Ozaki
Cell parameter for DOS of metal oxide clustersanjeev116962013/07/03 17:02
by T. Ozaki
optical conductivity unitsPavelSerba228482013/07/01 15:36
by T. Ozaki
KS determinantRuibin Liu625812013/07/01 15:32
by T. Ozaki
2013 database completionMauri113892013/06/25 17:54
by T. Ozaki
install openmx 3.7 on debian wheezy H T W117922013/06/25 14:28
by T.V.T. Duy
problem on installation openmx 3.7 with patch 3 on debian wheezyMa116612013/06/25 14:18
by T.V.T. Duy
OpenMX-3.7 installation problem on Fedora 17 surender662832013/06/17 09:26
by T. Ozaki
Electronic Temperature in openmxRuibin Liu533802013/06/16 11:52
by T. Ozaki
Units on .vhart.cubeJose Eduardo Padilha113732013/06/13 09:06
by T. Ozaki
Installation ErrorDogan Erbahar121652013/06/07 17:24
by alireza
electric fieldRuibin Liu115452013/06/04 21:00
by T. Ozaki
Patch 3.7.3 to OpenMX Ver. 3.7T. Ozaki017792013/06/03 17:24
by T. Ozaki
Hybrid functional B3LYPRuibin Liu116482013/06/03 09:59
by T. Ozaki
openmx 3.7 on intel_64Denis Music550822013/05/31 14:29
by Denis Music
openmx3.7 Installation problemSH5108842013/05/29 20:42
by Tamal Goswami
Patch 3.7.2 to OpenMX Ver. 3.7T. Ozaki016512013/05/29 17:37
by T. Ozaki
Patch 3.7.1 to OpenMX Ver. 3.7T. Ozaki013362013/05/27 14:56
by T. Ozaki
2013 database for heavy elementsJames114712013/05/24 20:47
by T. Ozaki
Release of OpenMX Ver. 3.7T. Ozaki011892013/05/23 12:02
by T. Ozaki
Exact exchange and hybrid functionalsMauro Sgroi215942013/05/16 23:15
by Mauro Sgroi
Can we specify the bias voltage applied to the left and right lead, respectively?Yasutaka Nishida218842013/05/16 19:17
by Yasutaka Nishida
How to compute the phonon dispersion by openmxT.Morshedloo016992013/04/30 17:34
by T.Morshedloo
segmentation fault during <logical truncation>Ruibin Liu012522013/04/18 10:26
by Ruibin Liu
question on FeO_NC.dat input filesanjeev015602013/03/25 17:15
by sanjeev
How to visualize charge density using XcrysdensJoao Amaral230842013/03/19 20:21
by Joao Amaral
Energy convergence requirementsAlfonso013352013/03/15 23:52
by Alfonso
Producing desired spin stateTamal Goswami013512013/02/27 17:40
by Tamal Goswami
Convergence issue of CoFe/MgO/CoFe sytem (MTJ)H.Park021972013/02/25 15:45
by H.Park
Basis vectors of Heusler alloy idu218452013/02/06 21:11
by idu
Energy of Fermi, HOMO and LUMOzhe016932013/01/18 23:36
by zhe
Memory problem?pesonkr017102013/01/18 12:24
by pesonkr
optical conductivityPavel Serba319372013/01/12 02:52
by PavelSerba

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