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Topics Author Replies Views Last Modified
To calculate dielectric constantGunn Kim019052008/11/27 14:44
by Gunn Kim
Problem with openmp/mpiKevin115312008/11/09 01:46
by Kevin
Be careful for U valuesJH Parq021952008/11/08 10:17
by JH Parq
geometry optimization problemYuzheng Guo08802008/11/04 00:02
by Yuzheng Guo
Segmentation fault in executing openmx?xue_bin wu015522008/11/02 04:03
by xue_bin wu
Errors when compiling DosMain V3.4Yonghong Zhao776532008/10/25 01:25
by Kyriakos Kachrimanis
Bug report : Empty atom failure on OpenMX 3.4H. Jeong019802008/10/22 10:23
by H. Jeong
appropriate Band.KPath.UnitCell and Band.Nkpath settingsKyriakos Kachrimanis014482008/10/07 02:46
by Kyriakos Kachrimanis
Relaxation of large system with defect, using new Eigenvalue-Following(EF) methodHeungsik Kim123142008/10/01 16:02
by Heungsik Kim
Openmx linking problemMauro Sgroi122702008/10/01 01:13
by Mauro Sgroi
comile error in openmx3.4Jaber Jahanbin328592008/09/24 14:25
by Heungsik Kim
Complex band structureR K Pandey021522008/09/11 10:37
by R K Pandey
give a help about installation: parallel compilationNauy Nux022932008/08/19 01:01
by Nauy Nux
how to switch off symmetryZhu Xi013052008/08/04 16:55
by Zhu Xi
parallel compilation problemXun Yuan128482008/07/29 10:53
by Duong Dinh Loc
weird and unreasonable total energies in Si-bulk geometry relaxationMauro023532008/07/26 05:11
by Mauro
Problem When test openmx with Alpha E45 machineDuong Dinh Loc019642008/07/24 00:18
by Duong Dinh Loc
a problem in installation of openMX3.4Xun Yuan116972008/07/15 22:56
by Mauro
I have problemes in openmx installation on fedora 8Jaber Jahanbin Sardr323202008/07/15 05:55
by Jaber Jahanbin Sardr
Question about Poles and residues in the ...codeLiger Chen014582008/07/03 20:16
by Liger Chen
ADPACK Ver. 2.1 and OpenMX Ver. 3.4 were releasedT.Ozaki11232008/07/01 10:09
by pem
orbital optimization problem:scaling factor divergingMauro121752008/06/27 18:08
by Mauro
OpenMx installation on Asus G2P laptopNaoto335892008/06/27 18:06
by Naoto
Reg Au_PBE.vpsDeepak123192008/06/27 11:52
by Yonghong Zhao
A question about DOSs of Si & AlYonghong Zhao223722008/06/12 22:52
by Yonghong Zhao
Too violet variation of "Uele" value under Electric field calculation ?Fuh Huei-Ru217002008/06/12 20:20
by Huei-Ru Fuh
Can I increase the number of point when calculating DOS?Yonghong Zhao213652008/06/12 10:28
by Yonghong Zhao
bccFe, the Fermi level is error?Yonghong Zhao219902008/06/12 09:47
by Yonghong Zhao
The discontinue output data of "filename.tden.cube"?Fuh Huei-Ru121822008/06/11 11:38
by T.Ozaki
Problem about 'case.vden' fileYonghong Zhao113742008/05/31 13:04
by Yonghong Zhao
ghost states for PbA. Lusakowski230962008/05/20 22:40
by A. Lusakowski
electric transportarchy116262008/05/16 18:24
by T.Ozaki
Problem Openmx3.3Alejandro 116712008/05/16 18:19
by T.Ozaki
Not enough data for PAOMauro117832008/04/25 21:10
by Mauro
Exchange coupling parameterT. R. Chang115632008/04/03 23:51
by Ali Sebetci
surface bombardmentDenis Music216772008/03/13 15:42
by Denis Music
How to distinguish different spins in band structure by non-collinear DFT with spin-orbit couplingYun Li127392008/02/06 10:29
by T.Ozaki
MPI version: unequal load balance over multiple CPUs....Rob486362008/01/19 18:52
by sutapa
About the calculation of magnetizationGunn Kim323762008/01/15 10:03
by T.Ozaki
Compiling MPI version of OpenMX with Intel compiler and MKLHeungsik Kim446822008/01/14 11:40
by Heungsik Kim
Geometry optimizationasaaravind118062007/12/24 21:54
by JH Parq
complex number in OpenMX codeH. Jeong217882007/12/24 02:14
by Vasilii Artyukhov
Orbital Polarization CorrectionA.Sebetci117762007/12/19 04:57
by T.Ozaki
Fermi EnergySumit Saxena114342007/12/18 20:36
by h. jeong
Atomic species definitionSumit Saxena260362007/12/18 20:25
by h. jeong
running openmx in backgroundSumit Saxena418072007/12/12 12:58
by Sumit Saxena
plotting band strucutre of cdteasaaravind015912007/12/06 18:38
by asaaravind
installation problem openmxSumit Saxena233232007/11/28 03:32
by Sumit Saxena
compile problem in IBM-merlin AIX5.2Zhu Xi121552007/11/22 17:08
by xiaohui qu
calculation Stopping at MD step=1 asaaravind116062007/11/09 13:54
by h. jeong

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