OpenMX Forum

| New Thread | Return Home | Points of Concern | Search | Past Log | Administration |

List of Threads Topics Author Replies Views Last Modified different energy using different initio spin Zhu Xi 2 1006 2007/05/30 17:11 by Yun Li makefile: clean tag bug Rob 1 976 2007/05/28 17:34 by T.Ozaki Re: A patch of OpenMX Ver. 3.2 Rob 1 1332 2007/05/28 17:29 by T.Ozaki efficient parallelization JessK 1 1284 2007/05/25 09:52 by T.Ozaki BAnd Dispersion of (3,0) carbon nanotube Jooya 1 1277 2007/05/25 09:46 by T.Ozaki k-point mesh Peter 3 1489 2007/05/18 00:25 by Vasilii Artyukhov problems with MD in OpenMX3.2 Denis Music 6 1316 2007/05/14 18:49 by Denis Music Installation error Kyung Ah Park 2 2322 2007/05/10 16:16 by Yun Li scf.restart option Peter 4 815 2007/04/23 15:11 by T.Ozaki a problem with CO.dat test JessK 1 1261 2007/04/22 17:45 by T.Ozaki A tip for geometry optimization T.Ozaki 0 1300 2007/04/13 11:33 by T.Ozaki A patch of OpenMX Ver. 3.2 T.Ozaki 0 607 2007/04/13 11:16 by T.Ozaki LDA+U method Allessandro Pennotti 1 1413 2007/04/05 09:01 by T.Ozaki how to choose optimal basis set Peter 2 726 2007/04/04 10:03 by Peter Release of OpenMX3.2 and ADPACK2.0 T.Ozaki 0 833 2007/04/02 06:49 by T.Ozaki OpenMX 3.1 on IBM P595 Jyh-Shyong Ho 14 1202 2007/03/26 23:04 by Jyh-Shyong Ho More OpenMX on IBM: FFTW3 Vasilii Artyukhov 0 881 2007/03/23 18:20 by Vasilii Artyukhov Research Scientist Jyh-Shyong Ho 0 621 2007/03/15 13:50 by Jyh-Shyong Ho BaTiO3 optical conductivity tigercuong 0 947 2007/03/12 20:14 by tigercuong Could you show me how to use DFTcalculation for QD Mr.CuongNT 1 1046 2007/02/21 14:04 by Xinyuan Zhang Selenium basis set shyam 1 820 2007/02/20 19:48 by Vasilii.Artyukhov undefined "Valence_Electrons" Huiqun Zhou 0 1021 2007/02/11 13:49 by Huiqun Zhou Problem about compilation error jacket Su 2 1018 2007/02/08 02:10 by jacket Su tips for PP generation Denis Music 3 1111 2007/02/08 00:20 by Denis Music I couldn't have installed OpenMX3.1!!! Help me Congkhtn 0 770 2007/02/05 14:14 by Congkhtn B-BOP again Vasilii Artyukhov 0 1059 2007/01/31 00:53 by Vasilii Artyukhov Runtest problem Zsolt 2 1393 2007/01/22 18:22 by Zsolt adapack1.8 - Generate_VNL.c routine Michele Gusso 0 911 2007/01/17 19:19 by Michele Gusso Adpack and partial core correction Guillaume Lucas 1 598 2007/01/16 00:02 by Guillaume Lucas large systems JessK 3 878 2007/01/13 01:27 by jessK Happy New Year to All OpenMX Users! Dung Tien 0 1124 2006/12/31 12:15 by Dung Tien Dimer binding energy Alexandre Tkatchenko 8 1073 2006/12/28 00:22 by T.Ozaki small suggestion hungdt 1 664 2006/12/18 19:32 by T.Ozaki Ceperly Alder Exchange-Correlation Michele Gusso 1 848 2006/12/07 11:51 by T.Ozaki coud you show me how to setup OnpenMX in Win Oper? Mr.Cong 7 731 2006/12/06 05:15 by alex Publications Vasilii Artyukhov 3 681 2006/12/05 23:56 by Vasilii Artyukhov How to construct peudopotential of fictitious atom Xinyuan Zhang 3 609 2006/12/01 23:49 by Vasilii Artyukhov opteron compilation error Aloysius 1 623 2006/12/01 18:23 by T.Ozaki About Transport calculation Hai-Ping Lan 3 921 2006/12/01 10:53 by T.Ozaki Charged System calculation Hai-Ping Lan 1 583 2006/11/29 14:31 by T.Ozaki a suggestion alex 1 419 2006/11/29 14:17 by T.Ozaki Trouble reading standard input Vasilii Artyukhov 1 588 2006/11/29 14:00 by T.Ozaki Constraint_Opt/DIIS in OPENMX 3.1 Thomas Gallauner 1 565 2006/11/29 13:20 by T.Ozaki Can you show me to detail use of OpenMX program? Mr.Cong 1 518 2006/11/22 02:03 by Pavel about charged molecule Xinyuan Zhang 2 1183 2006/11/22 01:13 by Xinyuan Zhang q: charges? basis sets/potentials validation? Grigory 2 2884 2006/11/18 22:59 by Grigory Bug fixed in OpenMX3.1, No.2 T.Ozaki 0 407 2006/11/17 00:44 by T.Ozaki Initial spin charges question? Dung Tien 2 685 2006/11/15 22:38 by Dung Tien Bug fixed in OpenMX3.1, No.1 T.Ozaki 0 404 2006/11/13 15:45 by T.Ozaki install problem for 3.1 verson Liger Chen 1 417 2006/11/10 18:26 by Liger Chen

Page: [1] [2] [3] [4] [5] [6] [7]

Open Thread    Locked Thread    Alarm（More than 90 replies）   Message from Administrator

- Web Patio -