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Topics Author Replies Views Last Modified
Be careful for U valuesJH Parq029652008/11/08 10:17
by JH Parq
geometry optimization problemYuzheng Guo016562008/11/04 00:02
by Yuzheng Guo
Segmentation fault in executing openmx?xue_bin wu07042008/11/02 04:03
by xue_bin wu
Errors when compiling DosMain V3.4Yonghong Zhao714252008/10/25 01:25
by Kyriakos Kachrimanis
Bug report : Empty atom failure on OpenMX 3.4H. Jeong026932008/10/22 10:23
by H. Jeong
appropriate Band.KPath.UnitCell and Band.Nkpath settingsKyriakos Kachrimanis022782008/10/07 02:46
by Kyriakos Kachrimanis
Relaxation of large system with defect, using new Eigenvalue-Following(EF) methodHeungsik Kim130652008/10/01 16:02
by Heungsik Kim
Openmx linking problemMauro Sgroi130952008/10/01 01:13
by Mauro Sgroi
comile error in openmx3.4Jaber Jahanbin338082008/09/24 14:25
by Heungsik Kim
Complex band structureR K Pandey029142008/09/11 10:37
by R K Pandey
give a help about installation: parallel compilationNauy Nux030812008/08/19 01:01
by Nauy Nux
how to switch off symmetryZhu Xi020382008/08/04 16:55
by Zhu Xi
parallel compilation problemXun Yuan136402008/07/29 10:53
by Duong Dinh Loc
weird and unreasonable total energies in Si-bulk geometry relaxationMauro030922008/07/26 05:11
by Mauro
Problem When test openmx with Alpha E45 machineDuong Dinh Loc027932008/07/24 00:18
by Duong Dinh Loc
a problem in installation of openMX3.4Xun Yuan124212008/07/15 22:56
by Mauro
I have problemes in openmx installation on fedora 8Jaber Jahanbin Sardr331422008/07/15 05:55
by Jaber Jahanbin Sardr
Question about Poles and residues in the ...codeLiger Chen022142008/07/03 20:16
by Liger Chen
ADPACK Ver. 2.1 and OpenMX Ver. 3.4 were releasedT.Ozaki18562008/07/01 10:09
by pem
orbital optimization problem:scaling factor divergingMauro130802008/06/27 18:08
by Mauro
OpenMx installation on Asus G2P laptopNaoto346492008/06/27 18:06
by Naoto
Reg Au_PBE.vpsDeepak132802008/06/27 11:52
by Yonghong Zhao
A question about DOSs of Si & AlYonghong Zhao231292008/06/12 22:52
by Yonghong Zhao
Too violet variation of "Uele" value under Electric field calculation ?Fuh Huei-Ru225262008/06/12 20:20
by Huei-Ru Fuh
Can I increase the number of point when calculating DOS?Yonghong Zhao221122008/06/12 10:28
by Yonghong Zhao
bccFe, the Fermi level is error?Yonghong Zhao227692008/06/12 09:47
by Yonghong Zhao
The discontinue output data of "filename.tden.cube"?Fuh Huei-Ru130962008/06/11 11:38
by T.Ozaki
Problem about 'case.vden' fileYonghong Zhao120952008/05/31 13:04
by Yonghong Zhao
ghost states for PbA. Lusakowski241172008/05/20 22:40
by A. Lusakowski
electric transportarchy124032008/05/16 18:24
by T.Ozaki
Problem Openmx3.3Alejandro 123772008/05/16 18:19
by T.Ozaki
Not enough data for PAOMauro126202008/04/25 21:10
by Mauro
Exchange coupling parameterT. R. Chang126182008/04/03 23:51
by Ali Sebetci
surface bombardmentDenis Music224002008/03/13 15:42
by Denis Music
How to distinguish different spins in band structure by non-collinear DFT with spin-orbit couplingYun Li144232008/02/06 10:29
by T.Ozaki
MPI version: unequal load balance over multiple CPUs....Rob4102132008/01/19 18:52
by sutapa
About the calculation of magnetizationGunn Kim331862008/01/15 10:03
by T.Ozaki
Compiling MPI version of OpenMX with Intel compiler and MKLHeungsik Kim462002008/01/14 11:40
by Heungsik Kim
Geometry optimizationasaaravind127572007/12/24 21:54
by JH Parq
complex number in OpenMX codeH. Jeong225112007/12/24 02:14
by Vasilii Artyukhov
Orbital Polarization CorrectionA.Sebetci125802007/12/19 04:57
by T.Ozaki
Fermi EnergySumit Saxena122372007/12/18 20:36
by h. jeong
Atomic species definitionSumit Saxena289352007/12/18 20:25
by h. jeong
running openmx in backgroundSumit Saxena427332007/12/12 12:58
by Sumit Saxena
plotting band strucutre of cdteasaaravind023302007/12/06 18:38
by asaaravind
installation problem openmxSumit Saxena243632007/11/28 03:32
by Sumit Saxena
compile problem in IBM-merlin AIX5.2Zhu Xi129562007/11/22 17:08
by xiaohui qu
calculation Stopping at MD step=1 asaaravind122982007/11/09 13:54
by h. jeong
Electric transport with version 3.3Xiaobing Feng024322007/11/02 17:52
by Xiaobing Feng
Periodic boundary conditionsFlorian Rovere133372007/10/31 02:20
by Florian Rovere

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