OpenMX Forum
New Thread | Return Home | Mailing List | Points of Concern | Search | Past Log | Administration    

List of Threads

Topics Author Replies Views Last Modified
how to switch off symmetryZhu Xi021842008/08/04 16:55
by Zhu Xi
parallel compilation problemXun Yuan137662008/07/29 10:53
by Duong Dinh Loc
weird and unreasonable total energies in Si-bulk geometry relaxationMauro032232008/07/26 05:11
by Mauro
Problem When test openmx with Alpha E45 machineDuong Dinh Loc029202008/07/24 00:18
by Duong Dinh Loc
a problem in installation of openMX3.4Xun Yuan125602008/07/15 22:56
by Mauro
I have problemes in openmx installation on fedora 8Jaber Jahanbin Sardr332782008/07/15 05:55
by Jaber Jahanbin Sardr
Question about Poles and residues in the ...codeLiger Chen023342008/07/03 20:16
by Liger Chen
ADPACK Ver. 2.1 and OpenMX Ver. 3.4 were releasedT.Ozaki19802008/07/01 10:09
by pem
orbital optimization problem:scaling factor divergingMauro132182008/06/27 18:08
by Mauro
OpenMx installation on Asus G2P laptopNaoto347942008/06/27 18:06
by Naoto
Reg Au_PBE.vpsDeepak134142008/06/27 11:52
by Yonghong Zhao
A question about DOSs of Si & AlYonghong Zhao232592008/06/12 22:52
by Yonghong Zhao
Too violet variation of "Uele" value under Electric field calculation ?Fuh Huei-Ru226742008/06/12 20:20
by Huei-Ru Fuh
Can I increase the number of point when calculating DOS?Yonghong Zhao222392008/06/12 10:28
by Yonghong Zhao
bccFe, the Fermi level is error?Yonghong Zhao229122008/06/12 09:47
by Yonghong Zhao
The discontinue output data of "filename.tden.cube"?Fuh Huei-Ru132372008/06/11 11:38
by T.Ozaki
Problem about 'case.vden' fileYonghong Zhao122742008/05/31 13:04
by Yonghong Zhao
ghost states for PbA. Lusakowski243862008/05/20 22:40
by A. Lusakowski
electric transportarchy125282008/05/16 18:24
by T.Ozaki
Problem Openmx3.3Alejandro 124982008/05/16 18:19
by T.Ozaki
Not enough data for PAOMauro127582008/04/25 21:10
by Mauro
Exchange coupling parameterT. R. Chang127912008/04/03 23:51
by Ali Sebetci
surface bombardmentDenis Music225452008/03/13 15:42
by Denis Music
How to distinguish different spins in band structure by non-collinear DFT with spin-orbit couplingYun Li146532008/02/06 10:29
by T.Ozaki
MPI version: unequal load balance over multiple CPUs....Rob4103652008/01/19 18:52
by sutapa
About the calculation of magnetizationGunn Kim333282008/01/15 10:03
by T.Ozaki
Compiling MPI version of OpenMX with Intel compiler and MKLHeungsik Kim463772008/01/14 11:40
by Heungsik Kim
Geometry optimizationasaaravind129032007/12/24 21:54
by JH Parq
complex number in OpenMX codeH. Jeong226402007/12/24 02:14
by Vasilii Artyukhov
Orbital Polarization CorrectionA.Sebetci127102007/12/19 04:57
by T.Ozaki
Fermi EnergySumit Saxena123782007/12/18 20:36
by h. jeong
Atomic species definitionSumit Saxena291552007/12/18 20:25
by h. jeong
running openmx in backgroundSumit Saxena428672007/12/12 12:58
by Sumit Saxena
plotting band strucutre of cdteasaaravind024622007/12/06 18:38
by asaaravind
installation problem openmxSumit Saxena245252007/11/28 03:32
by Sumit Saxena
compile problem in IBM-merlin AIX5.2Zhu Xi130932007/11/22 17:08
by xiaohui qu
calculation Stopping at MD step=1 asaaravind124162007/11/09 13:54
by h. jeong
Electric transport with version 3.3Xiaobing Feng025572007/11/02 17:52
by Xiaobing Feng
Periodic boundary conditionsFlorian Rovere134772007/10/31 02:20
by Florian Rovere
the SCF steps is so much on each EF step....Liger Chen231042007/10/22 21:14
by asaaravind
One more question about the "Note on Recursion Methods"Yang Xu124142007/10/20 23:19
by T.Ozaki
Linking error with gcc on OSXDavid Benoit243612007/10/09 00:03
by David Benoit
Some questions about the "Note on Recursion Methods"Yang Xu233732007/10/07 15:42
by Yang Xu
OpenMX with icc10 / gcc4+gfortran4 / sunstudio12Pawel Lesniak035572007/10/03 07:18
by Pawel Lesniak
database, equilibrium constant and binding energyH. Kino028102007/09/26 16:00
by H. Kino
queation about DIIS ,H matrix.Liger Chen131512007/09/25 17:03
by T.Ozaki
Segmentation fault with scf.ProExpn.VNA=offMichele Gusso128372007/09/25 16:16
by T.Ozaki
How to re-start MD?Zhu Xi129132007/09/21 20:04
by Liger Chen
Problems about basis function MMQS110362007/09/01 18:41
by T.Ozaki
referencesAlejandro León126582007/09/01 18:37
by T.Ozaki

Page: [1] [2] [3] [4] [5] [6] [7] [8] [9] [10] [11] [12] [13] [14] [15] [16] [17] [18] [19] [20] [21] [22] [23] [24] [25] [26] [27] [28] [29] [30]


Open Thread    Locked Thread    Alarm(More than 900 replies)   Message from Administrator


- Web Patio -