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Topics Author Replies Views Last Modified
Complex band structureR K Pandey032682008/09/11 10:37
by R K Pandey
give a help about installation: parallel compilationNauy Nux034342008/08/19 01:01
by Nauy Nux
how to switch off symmetryZhu Xi024002008/08/04 16:55
by Zhu Xi
parallel compilation problemXun Yuan139752008/07/29 10:53
by Duong Dinh Loc
weird and unreasonable total energies in Si-bulk geometry relaxationMauro034332008/07/26 05:11
by Mauro
Problem When test openmx with Alpha E45 machineDuong Dinh Loc031242008/07/24 00:18
by Duong Dinh Loc
a problem in installation of openMX3.4Xun Yuan127712008/07/15 22:56
by Mauro
I have problemes in openmx installation on fedora 8Jaber Jahanbin Sardr334902008/07/15 05:55
by Jaber Jahanbin Sardr
Question about Poles and residues in the ...codeLiger Chen025562008/07/03 20:16
by Liger Chen
ADPACK Ver. 2.1 and OpenMX Ver. 3.4 were releasedT.Ozaki111842008/07/01 10:09
by pem
orbital optimization problem:scaling factor divergingMauro134482008/06/27 18:08
by Mauro
OpenMx installation on Asus G2P laptopNaoto350272008/06/27 18:06
by Naoto
Reg Au_PBE.vpsDeepak136112008/06/27 11:52
by Yonghong Zhao
A question about DOSs of Si & AlYonghong Zhao234682008/06/12 22:52
by Yonghong Zhao
Too violet variation of "Uele" value under Electric field calculation ?Fuh Huei-Ru229362008/06/12 20:20
by Huei-Ru Fuh
Can I increase the number of point when calculating DOS?Yonghong Zhao224692008/06/12 10:28
by Yonghong Zhao
bccFe, the Fermi level is error?Yonghong Zhao231382008/06/12 09:47
by Yonghong Zhao
The discontinue output data of "filename.tden.cube"?Fuh Huei-Ru134682008/06/11 11:38
by T.Ozaki
Problem about 'case.vden' fileYonghong Zhao124822008/05/31 13:04
by Yonghong Zhao
ghost states for PbA. Lusakowski247002008/05/20 22:40
by A. Lusakowski
electric transportarchy127422008/05/16 18:24
by T.Ozaki
Problem Openmx3.3Alejandro 127202008/05/16 18:19
by T.Ozaki
Not enough data for PAOMauro129992008/04/25 21:10
by Mauro
Exchange coupling parameterT. R. Chang130552008/04/03 23:51
by Ali Sebetci
surface bombardmentDenis Music227682008/03/13 15:42
by Denis Music
How to distinguish different spins in band structure by non-collinear DFT with spin-orbit couplingYun Li150122008/02/06 10:29
by T.Ozaki
MPI version: unequal load balance over multiple CPUs....Rob4107002008/01/19 18:52
by sutapa
About the calculation of magnetizationGunn Kim335582008/01/15 10:03
by T.Ozaki
Compiling MPI version of OpenMX with Intel compiler and MKLHeungsik Kim466062008/01/14 11:40
by Heungsik Kim
Geometry optimizationasaaravind131402007/12/24 21:54
by JH Parq
complex number in OpenMX codeH. Jeong228772007/12/24 02:14
by Vasilii Artyukhov
Orbital Polarization CorrectionA.Sebetci129322007/12/19 04:57
by T.Ozaki
Fermi EnergySumit Saxena125822007/12/18 20:36
by h. jeong
Atomic species definitionSumit Saxena294782007/12/18 20:25
by h. jeong
running openmx in backgroundSumit Saxena430902007/12/12 12:58
by Sumit Saxena
plotting band strucutre of cdteasaaravind026762007/12/06 18:38
by asaaravind
installation problem openmxSumit Saxena247842007/11/28 03:32
by Sumit Saxena
compile problem in IBM-merlin AIX5.2Zhu Xi133082007/11/22 17:08
by xiaohui qu
calculation Stopping at MD step=1 asaaravind126282007/11/09 13:54
by h. jeong
Electric transport with version 3.3Xiaobing Feng027552007/11/02 17:52
by Xiaobing Feng
Periodic boundary conditionsFlorian Rovere137332007/10/31 02:20
by Florian Rovere
the SCF steps is so much on each EF step....Liger Chen233362007/10/22 21:14
by asaaravind
One more question about the "Note on Recursion Methods"Yang Xu126432007/10/20 23:19
by T.Ozaki
Linking error with gcc on OSXDavid Benoit245882007/10/09 00:03
by David Benoit
Some questions about the "Note on Recursion Methods"Yang Xu235942007/10/07 15:42
by Yang Xu
OpenMX with icc10 / gcc4+gfortran4 / sunstudio12Pawel Lesniak037582007/10/03 07:18
by Pawel Lesniak
database, equilibrium constant and binding energyH. Kino030292007/09/26 16:00
by H. Kino
queation about DIIS ,H matrix.Liger Chen133992007/09/25 17:03
by T.Ozaki
Segmentation fault with scf.ProExpn.VNA=offMichele Gusso130562007/09/25 16:16
by T.Ozaki
How to re-start MD?Zhu Xi131382007/09/21 20:04
by Liger Chen

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