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List of Threads Topics Author Replies Views Last Modified is it possible for plus diffuse orbital ? Liger Chen 1 1839 2006/10/12 23:01 by T.Ozaki Binding energy calculation K. Bart 1 2614 2006/10/12 22:52 by T.Ozaki error message ...p4_error: interrupt SIGSEGV: 11.. Liger Chen 1 7861 2006/10/12 22:36 by T.Ozaki Transition state search on OpenMX Dung Tien 2 1969 2006/10/04 11:10 by Dung Tien STM image Pavel 1 1627 2006/10/03 23:23 by T.Ozaki Segmentation Fault for openMX MPI version 3.0 KC 4 2526 2006/09/29 14:31 by T.Ozaki Dr. Hyuk Soon Choi 2 2001 2006/09/29 09:31 by Hyuk Soon Choi scf converge problem Liger Chen 2 2288 2006/09/26 16:01 by Liger Chen Hard to converge for geometric optimizer. Xinyuan Zhang 7 1609 2006/09/21 16:56 by Xinyuan what is the meaning of the error warning ? Liger Cheb 3 3982 2006/09/20 14:56 by Liger Chen Calculation of Work Function with Yukihiro Okuno 1 2670 2006/09/19 10:53 by T.Ozaki B-BOP Xinyuan Zhang 1 1878 2006/09/19 10:41 by T.Ozaki Help with NVT Si Bulk Simulation Ravi M 2 2054 2006/08/25 12:51 by Ravi M Miss christine 1 1581 2006/08/18 12:58 by T.Ozaki memory issues jessK 1 1681 2006/08/11 09:10 by T.Ozaki A unknown problem Xinyuan Zhang 1 1700 2006/08/11 09:02 by T.Ozaki Tetrahedron method applicability Vasilii Artyukhov 1 1959 2006/08/11 09:00 by T.Ozaki A question about basis set Peter Winey 2 2313 2006/07/10 23:49 by Peter Winey Forces and symmetry Peter Winey 2 2253 2006/07/10 23:28 by Peter Winey Database (2006) of PAO and VPS available T.Ozaki 2 2018 2006/06/30 23:54 by Peter Winey Installation - undefined reference Jan 1 2311 2006/06/27 23:11 by Jan How to fix the fault of running large-scale system Gn. Plott 1 1740 2006/06/16 11:32 by T.Ozaki magnetic moment jessK 3 2061 2006/06/14 11:30 by T.Ozaki adpack1.8: first deriv. discont. of excited states M. Gusso 1 1853 2006/06/13 22:10 by T.Ozaki adpack1.8: high grid.xmax parameter M. Gusso 1 1936 2006/06/13 22:02 by T.Ozaki Band, Cluster, and DC ? F Li 1 1772 2006/06/13 21:50 by T.Ozaki LBFGS optimizer jessK 1 1754 2006/06/06 20:34 by T.Ozaki K-point grid jessK 1 2023 2006/06/06 10:46 by T.Ozaki OpenMX in surface? JinLong 1 1664 2006/05/31 18:29 by T.Ozaki Running jobs in a directory other than "work" Peter Winey 3 2634 2006/05/24 11:15 by T.Ozaki Exception error with big system John Tse 1 1804 2006/05/19 11:52 by T.Ozaki parallel questions Jeason 1 2321 2006/05/12 10:44 by T.Ozaki Prof. John Tse 1 1734 2006/05/11 20:52 by T.Ozaki Bad installation Pavel B Sorokin 6 3056 2006/05/11 18:27 by Pavel B Sorokin Big carbon nanotube structure Vasilii Artyukhov 1 1967 2006/04/29 01:58 by T.Ozaki BBOP and OXON Hai-Ping Lan 1 1816 2006/04/24 18:50 by T.Ozaki Pseudo for N Veronika Listyani 1 1563 2006/04/21 21:51 by T.Ozaki Compilation error Jeason 3 3033 2006/04/21 21:49 by T.Ozaki Nonorthogonality Alexander Fedorov 1 1632 2006/04/21 21:46 by T.Ozaki How to extract data such as workfunction? Hai-Ping Lan 1 1717 2006/04/06 19:32 by T.Ozaki LAM/MPI compilation error Jeason 1 2474 2006/04/06 11:47 by T.Ozaki undefined reference to fftw... Veronika Listyani 1 3271 2006/04/06 11:42 by T.Ozaki traditional diagonalization veronika listyani 2 1753 2006/04/05 12:26 by Veronika Listyani illegal value for mathfunction Hai-Ping Lan 1 4053 2006/03/27 09:29 by T.Ozaki Runing Error of parallel version! Hai-Ping Lan 1 1964 2006/03/27 00:47 by T.Ozaki Compiling failure when linking mathlib Hai-Ping Lan 2 1894 2006/03/24 23:49 by Hai-Ping Lan Problems about CLAPACK Hai-Ping Lan 2 3628 2006/03/24 14:39 by Hai-Ping Lan Bugs in MD_pac.c of OpenMX Ver. 3.0 T.Ozaki 0 1707 2006/03/24 00:54 by T.Ozaki OpenMX Ver 3.0 release T.Ozaki 0 1499 2006/03/21 02:59 by T.Ozaki Problem with fftw-3.1 Jeong 0 1429 2006/03/15 05:49 by Jeong

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