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Topics Author Replies Views Last Modified
About Transport calculationHai-Ping Lan321642006/12/01 10:53
by T.Ozaki
Charged System calculationHai-Ping Lan115152006/11/29 14:31
by T.Ozaki
a suggestionalex114272006/11/29 14:17
by T.Ozaki
Trouble reading standard inputVasilii Artyukhov114882006/11/29 14:00
by T.Ozaki
Constraint_Opt/DIIS in OPENMX 3.1Thomas Gallauner114762006/11/29 13:20
by T.Ozaki
Can you show me to detail use of OpenMX program?Mr.Cong116372006/11/22 02:03
by Pavel
about charged moleculeXinyuan Zhang221882006/11/22 01:13
by Xinyuan Zhang
q: charges? basis sets/potentials validation?Grigory216062006/11/18 22:59
by Grigory
Bug fixed in OpenMX3.1, No.2T.Ozaki013582006/11/17 00:44
by T.Ozaki
Initial spin charges question?Dung Tien217962006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki013732006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen113492006/11/10 18:26
by Liger Chen
Does B-Bop do DOS?Vasilii Artyukhov212822006/11/09 22:04
by Vasilii Artyukhov
the molecular orbitalXinyuan Zhang117522006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu020182006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK339172006/11/05 00:05
by T.Ozaki
Memory UsageKevin216172006/11/04 06:41
by JessK
non convergence calculation problem!sabri119202006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki011882006/11/04 01:48
by T.Ozaki
Velocities in MDPavel112042006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen113912006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin215642006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK127032006/11/01 10:15
by T.Ozaki
LDA+U energyjessK216852006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong113942006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen115262006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart122532006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen168132006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien216912006/10/04 11:10
by Dung Tien
STM imagePavel113552006/10/03 23:23
by T.Ozaki
Segmentation Fault for openMX MPI version 3.0KC420842006/09/29 14:31
by T.Ozaki
Dr.Hyuk Soon Choi215882006/09/29 09:31
by Hyuk Soon Choi
scf converge problem Liger Chen218212006/09/26 16:01
by Liger Chen
Hard to converge for geometric optimizer.Xinyuan Zhang75332006/09/21 16:56
by Xinyuan
what is the meaning of the error warning ?Liger Cheb335382006/09/20 14:56
by Liger Chen
Calculation of Work Function with Yukihiro Okuno122782006/09/19 10:53
by T.Ozaki
B-BOPXinyuan Zhang115562006/09/19 10:41
by T.Ozaki
Help with NVT Si Bulk SimulationRavi M217432006/08/25 12:51
by Ravi M
Misschristine112782006/08/18 12:58
by T.Ozaki
memory issuesjessK113632006/08/11 09:10
by T.Ozaki
A unknown problemXinyuan Zhang114062006/08/11 09:02
by T.Ozaki
Tetrahedron method applicabilityVasilii Artyukhov116632006/08/11 09:00
by T.Ozaki
A question about basis setPeter Winey219422006/07/10 23:49
by Peter Winey
Forces and symmetryPeter Winey218032006/07/10 23:28
by Peter Winey
Database (2006) of PAO and VPS availableT.Ozaki216462006/06/30 23:54
by Peter Winey
Installation - undefined referenceJan119672006/06/27 23:11
by Jan
How to fix the fault of running large-scale systemGn. Plott114682006/06/16 11:32
by T.Ozaki
magnetic momentjessK316382006/06/14 11:30
by T.Ozaki
adpack1.8: first deriv. discont. of excited statesM. Gusso115572006/06/13 22:10
by T.Ozaki
adpack1.8: high grid.xmax parameterM. Gusso115822006/06/13 22:02
by T.Ozaki

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