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Topics Author Replies Views Last Modified
Initial spin charges question?Dung Tien227942006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki024432006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen122402006/11/10 18:26
by Liger Chen
Does B-Bop do DOS?Vasilii Artyukhov221632006/11/09 22:04
by Vasilii Artyukhov
the molecular orbitalXinyuan Zhang128022006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu030642006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK349632006/11/05 00:05
by T.Ozaki
Memory UsageKevin225772006/11/04 06:41
by JessK
non convergence calculation problem!sabri130272006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki021022006/11/04 01:48
by T.Ozaki
Velocities in MDPavel121372006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen123412006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin226552006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK138212006/11/01 10:15
by T.Ozaki
LDA+U energyjessK227792006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong122872006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen124602006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart135572006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen190072006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien226622006/10/04 11:10
by Dung Tien
STM imagePavel122502006/10/03 23:23
by T.Ozaki
Segmentation Fault for openMX MPI version 3.0KC433252006/09/29 14:31
by T.Ozaki
Dr.Hyuk Soon Choi226842006/09/29 09:31
by Hyuk Soon Choi
scf converge problem Liger Chen229182006/09/26 16:01
by Liger Chen
Hard to converge for geometric optimizer.Xinyuan Zhang726882006/09/21 16:56
by Xinyuan
what is the meaning of the error warning ?Liger Cheb346172006/09/20 14:56
by Liger Chen
Calculation of Work Function with Yukihiro Okuno134012006/09/19 10:53
by T.Ozaki
B-BOPXinyuan Zhang124902006/09/19 10:41
by T.Ozaki
Help with NVT Si Bulk SimulationRavi M227072006/08/25 12:51
by Ravi M
Misschristine122432006/08/18 12:58
by T.Ozaki
memory issuesjessK122512006/08/11 09:10
by T.Ozaki
A unknown problemXinyuan Zhang124682006/08/11 09:02
by T.Ozaki
Tetrahedron method applicabilityVasilii Artyukhov127182006/08/11 09:00
by T.Ozaki
A question about basis setPeter Winey229112006/07/10 23:49
by Peter Winey
Forces and symmetryPeter Winey231582006/07/10 23:28
by Peter Winey
Database (2006) of PAO and VPS availableT.Ozaki226762006/06/30 23:54
by Peter Winey
Installation - undefined referenceJan129362006/06/27 23:11
by Jan
How to fix the fault of running large-scale systemGn. Plott123242006/06/16 11:32
by T.Ozaki
magnetic momentjessK330242006/06/14 11:30
by T.Ozaki
adpack1.8: first deriv. discont. of excited statesM. Gusso124462006/06/13 22:10
by T.Ozaki
adpack1.8: high grid.xmax parameterM. Gusso126002006/06/13 22:02
by T.Ozaki
Band, Cluster, and DC ?F Li124032006/06/13 21:50
by T.Ozaki
LBFGS optimizerjessK123762006/06/06 20:34
by T.Ozaki
K-point gridjessK126582006/06/06 10:46
by T.Ozaki
OpenMX in surface?JinLong122392006/05/31 18:29
by T.Ozaki
Running jobs in a directory other than "work"Peter Winey334542006/05/24 11:15
by T.Ozaki
Exception error with big systemJohn Tse125512006/05/19 11:52
by T.Ozaki
parallel questionsJeason129642006/05/12 10:44
by T.Ozaki
Prof.John Tse123822006/05/11 20:52
by T.Ozaki
Bad installationPavel B Sorokin637062006/05/11 18:27
by Pavel B Sorokin

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