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Topics Author Replies Views Last Modified
How to print out derivatives of individual H and S matrix elementsLK112842013/08/30 17:51
by T. Ozaki
Patch 3.7.5 to OpenMX Ver. 3.7T. Ozaki017122013/08/29 17:53
by T. Ozaki
openmx3.7Gary Washington113822013/08/23 21:52
by T. Ozaki
Difference in total energy between version 3.6 and 3.7Bob Schoeters218202013/08/02 16:53
by Bob Schoeters
Calculate energy with constrained magnitude of magnetic momentPui-Wai Ma113622013/08/01 22:28
by T. Ozaki
Non-local potential EXcluded from vo.cube and v1.cube: why? Leonardo Makinistian217672013/07/26 18:43
by Leonardo Makinistian
Patch 3.7.4 to OpenMX Ver. 3.7T. Ozaki217862013/07/26 13:23
by T. Ozaki
OPENMX 3.7 Installation problemKanagaraj C840672013/07/16 15:57
by Kanagaraj C
LCAOzahra113192013/07/11 17:48
by T. Ozaki
Cell parameter for DOS of metal oxide clustersanjeev115242013/07/03 17:02
by T. Ozaki
optical conductivity unitsPavelSerba225682013/07/01 15:36
by T. Ozaki
KS determinantRuibin Liu623882013/07/01 15:32
by T. Ozaki
2013 database completionMauri111972013/06/25 17:54
by T. Ozaki
install openmx 3.7 on debian wheezy H T W115952013/06/25 14:28
by T.V.T. Duy
problem on installation openmx 3.7 with patch 3 on debian wheezyMa114922013/06/25 14:18
by T.V.T. Duy
OpenMX-3.7 installation problem on Fedora 17 surender659092013/06/17 09:26
by T. Ozaki
Electronic Temperature in openmxRuibin Liu528792013/06/16 11:52
by T. Ozaki
Units on .vhart.cubeJose Eduardo Padilha112012013/06/13 09:06
by T. Ozaki
Installation ErrorDogan Erbahar119342013/06/07 17:24
by alireza
electric fieldRuibin Liu113472013/06/04 21:00
by T. Ozaki
Patch 3.7.3 to OpenMX Ver. 3.7T. Ozaki016052013/06/03 17:24
by T. Ozaki
Hybrid functional B3LYPRuibin Liu114382013/06/03 09:59
by T. Ozaki
openmx 3.7 on intel_64Denis Music547712013/05/31 14:29
by Denis Music
openmx3.7 Installation problemSH597752013/05/29 20:42
by Tamal Goswami
Patch 3.7.2 to OpenMX Ver. 3.7T. Ozaki014552013/05/29 17:37
by T. Ozaki
Patch 3.7.1 to OpenMX Ver. 3.7T. Ozaki011552013/05/27 14:56
by T. Ozaki
2013 database for heavy elementsJames112692013/05/24 20:47
by T. Ozaki
Release of OpenMX Ver. 3.7T. Ozaki09992013/05/23 12:02
by T. Ozaki
Exact exchange and hybrid functionalsMauro Sgroi214062013/05/16 23:15
by Mauro Sgroi
Can we specify the bias voltage applied to the left and right lead, respectively?Yasutaka Nishida216732013/05/16 19:17
by Yasutaka Nishida
How to compute the phonon dispersion by openmxT.Morshedloo014802013/04/30 17:34
by T.Morshedloo
segmentation fault during <logical truncation>Ruibin Liu010882013/04/18 10:26
by Ruibin Liu
question on FeO_NC.dat input filesanjeev013332013/03/25 17:15
by sanjeev
How to visualize charge density using XcrysdensJoao Amaral227702013/03/19 20:21
by Joao Amaral
Energy convergence requirementsAlfonso011632013/03/15 23:52
by Alfonso
Producing desired spin stateTamal Goswami011802013/02/27 17:40
by Tamal Goswami
Convergence issue of CoFe/MgO/CoFe sytem (MTJ)H.Park019982013/02/25 15:45
by H.Park
Basis vectors of Heusler alloy idu216332013/02/06 21:11
by idu
Energy of Fermi, HOMO and LUMOzhe014662013/01/18 23:36
by zhe
Memory problem?pesonkr015192013/01/18 12:24
by pesonkr
optical conductivityPavel Serba317542013/01/12 02:52
by PavelSerba
Zero Point Energy (ZPE) correctionNima015682013/01/11 02:53
by Nima
installationZahra123432013/01/10 20:25
by surender
Numerical error of force and total energy by the Gauss-Legendre quadrature in Total_Energy.cA. M. Ito222342012/12/28 13:41
by A. M. Ito
Installation error on Fedora 17Wang daobin130952012/12/28 07:03
by Surender
pseudopotentials for LanthanideFraser011292012/12/20 13:55
by Fraser
computations of adsorption of NO on TiO2marzi014822012/12/02 19:24
by marzi
Fe/MgO/Fe calculation Kamaram Munira018452012/12/01 00:55
by Kamaram Munira
Problems with convergenceJan Rusz321742012/11/30 22:54
by Jan Rusz
Transport calculation in Fe-MgO-Fe system, LEFT lead cannot be superposed on the original cellKamaram017052012/11/27 02:24
by Kamaram

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