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Topics Author Replies Views Last Modified
different energy using different initio spinZhu Xi222432007/05/30 17:11
by Yun Li
makefile: clean tag bugRob122602007/05/28 17:34
by T.Ozaki
Re: A patch of OpenMX Ver. 3.2Rob124362007/05/28 17:29
by T.Ozaki
efficient parallelization JessK123522007/05/25 09:52
by T.Ozaki
BAnd Dispersion of (3,0) carbon nanotubeJooya125782007/05/25 09:46
by T.Ozaki
k-point meshPeter348252007/05/18 00:25
by Vasilii Artyukhov
problems with MD in OpenMX3.2Denis Music629932007/05/14 18:49
by Denis Music
Installation errorKyung Ah Park240672007/05/10 16:16
by Yun Li
scf.restart optionPeter426082007/04/23 15:11
by T.Ozaki
a problem with CO.dat testJessK19412007/04/22 17:45
by T.Ozaki
A tip for geometry optimizationT.Ozaki025932007/04/13 11:33
by T.Ozaki
A patch of OpenMX Ver. 3.2 T.Ozaki017212007/04/13 11:16
by T.Ozaki
LDA+U methodAllessandro Pennotti129352007/04/05 09:01
by T.Ozaki
how to choose optimal basis setPeter225912007/04/04 10:03
by Peter
Release of OpenMX3.2 and ADPACK2.0T.Ozaki018852007/04/02 06:49
by T.Ozaki
OpenMX 3.1 on IBM P595Jyh-Shyong Ho1440432007/03/26 23:04
by Jyh-Shyong Ho
More OpenMX on IBM: FFTW3Vasilii Artyukhov020992007/03/23 18:20
by Vasilii Artyukhov
Research ScientistJyh-Shyong Ho019862007/03/15 13:50
by Jyh-Shyong Ho
BaTiO3 optical conductivitytigercuong024882007/03/12 20:14
by tigercuong
Could you show me how to use DFTcalculation for QDMr.CuongNT122782007/02/21 14:04
by Xinyuan Zhang
Selenium basis set shyam126472007/02/20 19:48
by Vasilii.Artyukhov
undefined "Valence_Electrons"Huiqun Zhou021922007/02/11 13:49
by Huiqun Zhou
Problem about compilation errorjacket Su227482007/02/08 02:10
by jacket Su
tips for PP generationDenis Music325552007/02/08 00:20
by Denis Music
I couldn't have installed OpenMX3.1!!! Help meCongkhtn018632007/02/05 14:14
by Congkhtn
B-BOP againVasilii Artyukhov023802007/01/31 00:53
by Vasilii Artyukhov
Runtest problemZsolt240982007/01/22 18:22
by Zsolt
adapack1.8 - Generate_VNL.c routineMichele Gusso020312007/01/17 19:19
by Michele Gusso
Adpack and partial core correctionGuillaume Lucas118352007/01/16 00:02
by Guillaume Lucas
large systemsJessK321892007/01/13 01:27
by jessK
Happy New Year to All OpenMX Users!Dung Tien022382006/12/31 12:15
by Dung Tien
Dimer binding energyAlexandre Tkatchenko850062006/12/28 00:22
by T.Ozaki
small suggestionhungdt118132006/12/18 19:32
by T.Ozaki
Ceperly Alder Exchange-CorrelationMichele Gusso122182006/12/07 11:51
by T.Ozaki
coud you show me how to setup OnpenMX in Win Oper?Mr.Cong723252006/12/06 05:15
by alex
PublicationsVasilii Artyukhov319642006/12/05 23:56
by Vasilii Artyukhov
How to construct peudopotential of fictitious atomXinyuan Zhang320092006/12/01 23:49
by Vasilii Artyukhov
opteron compilation errorAloysius123512006/12/01 18:23
by T.Ozaki
About Transport calculationHai-Ping Lan324482006/12/01 10:53
by T.Ozaki
Charged System calculationHai-Ping Lan117962006/11/29 14:31
by T.Ozaki
a suggestionalex116932006/11/29 14:17
by T.Ozaki
Trouble reading standard inputVasilii Artyukhov116902006/11/29 14:00
by T.Ozaki
Constraint_Opt/DIIS in OPENMX 3.1Thomas Gallauner116972006/11/29 13:20
by T.Ozaki
Can you show me to detail use of OpenMX program?Mr.Cong119012006/11/22 02:03
by Pavel
about charged moleculeXinyuan Zhang224292006/11/22 01:13
by Xinyuan Zhang
q: charges? basis sets/potentials validation?Grigory218762006/11/18 22:59
by Grigory
Bug fixed in OpenMX3.1, No.2T.Ozaki016102006/11/17 00:44
by T.Ozaki
Initial spin charges question?Dung Tien220672006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki016212006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen115622006/11/10 18:26
by Liger Chen

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