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Topics Author Replies Views Last Modified
the molecular orbitalXinyuan Zhang126972006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu029862006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK348742006/11/05 00:05
by T.Ozaki
Memory UsageKevin225072006/11/04 06:41
by JessK
non convergence calculation problem!sabri129542006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki020292006/11/04 01:48
by T.Ozaki
Velocities in MDPavel120592006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen122762006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin225702006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK137352006/11/01 10:15
by T.Ozaki
LDA+U energyjessK227002006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong122212006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen123812006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart134482006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen189272006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien225762006/10/04 11:10
by Dung Tien
STM imagePavel121712006/10/03 23:23
by T.Ozaki
Segmentation Fault for openMX MPI version 3.0KC432272006/09/29 14:31
by T.Ozaki
Dr.Hyuk Soon Choi226222006/09/29 09:31
by Hyuk Soon Choi
scf converge problem Liger Chen228502006/09/26 16:01
by Liger Chen
Hard to converge for geometric optimizer.Xinyuan Zhang726112006/09/21 16:56
by Xinyuan
what is the meaning of the error warning ?Liger Cheb345572006/09/20 14:56
by Liger Chen
Calculation of Work Function with Yukihiro Okuno133322006/09/19 10:53
by T.Ozaki
B-BOPXinyuan Zhang124282006/09/19 10:41
by T.Ozaki
Help with NVT Si Bulk SimulationRavi M226312006/08/25 12:51
by Ravi M
Misschristine121742006/08/18 12:58
by T.Ozaki
memory issuesjessK121932006/08/11 09:10
by T.Ozaki
A unknown problemXinyuan Zhang123892006/08/11 09:02
by T.Ozaki
Tetrahedron method applicabilityVasilii Artyukhov126472006/08/11 09:00
by T.Ozaki
A question about basis setPeter Winey228392006/07/10 23:49
by Peter Winey
Forces and symmetryPeter Winey230482006/07/10 23:28
by Peter Winey
Database (2006) of PAO and VPS availableT.Ozaki226012006/06/30 23:54
by Peter Winey
Installation - undefined referenceJan128702006/06/27 23:11
by Jan
How to fix the fault of running large-scale systemGn. Plott122602006/06/16 11:32
by T.Ozaki
magnetic momentjessK329382006/06/14 11:30
by T.Ozaki
adpack1.8: first deriv. discont. of excited statesM. Gusso123722006/06/13 22:10
by T.Ozaki
adpack1.8: high grid.xmax parameterM. Gusso125332006/06/13 22:02
by T.Ozaki
Band, Cluster, and DC ?F Li123352006/06/13 21:50
by T.Ozaki
LBFGS optimizerjessK123112006/06/06 20:34
by T.Ozaki
K-point gridjessK125882006/06/06 10:46
by T.Ozaki
OpenMX in surface?JinLong121712006/05/31 18:29
by T.Ozaki
Running jobs in a directory other than "work"Peter Winey333732006/05/24 11:15
by T.Ozaki
Exception error with big systemJohn Tse124752006/05/19 11:52
by T.Ozaki
parallel questionsJeason128992006/05/12 10:44
by T.Ozaki
Prof.John Tse123002006/05/11 20:52
by T.Ozaki
Bad installationPavel B Sorokin636382006/05/11 18:27
by Pavel B Sorokin
Big carbon nanotube structureVasilii Artyukhov125802006/04/29 01:58
by T.Ozaki
BBOP and OXONHai-Ping Lan123482006/04/24 18:50
by T.Ozaki
Pseudo for NVeronika Listyani121472006/04/21 21:51
by T.Ozaki
Compilation errorJeason336782006/04/21 21:49
by T.Ozaki

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