Answered questions for Siesta

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Summary Created Submitter Assignee Status
Answered 668529 basal plane electrode problem in the scattering region calculation 2018-05-03 01:39:48 UTC 2018-05-03 nayana devaraj Answered
Answered 667607 Intel 2018 + OSX + Siesta Compilation Errors when linking 2018-04-06 02:52:52 UTC 2018-04-06 Jesse Quinn Answered
Solved 667589 TBTrans output and current vs voltage calculation 2018-04-05 09:11:06 UTC 2018-04-05 Manas Solved
Answered 667534 Transiesta general 2018-04-04 06:23:39 UTC 2018-04-04 Prabhleen Kaur Answered
Answered 667527 running ts_au_100_0.25V example 2018-04-03 19:13:58 UTC 2018-04-03 Herbert Fruchtl Answered
Solved 667226 siesta netcdf4 file output 2018-03-26 02:45:15 UTC 2018-03-26 GuodongYu Solved
Solved 667118 Hamiltonian formate and how to read it 2018-03-23 07:22:39 UTC 2018-03-23 GuodongYu Solved
Solved 665721 convergence problem with transiesta 2018-03-16 14:50:34 UTC 2018-03-16 Samuel Dechamps Solved
Solved 665584 failure to converge FD step function 2018-03-14 17:26:04 UTC 2018-03-14 daniel aravena Solved
Answered 665219 User.Basis true gives seg fault 2018-03-04 21:15:54 UTC 2018-03-04 Leonardo Fonseca Nick Papior Answered
Solved 663856 Transmission and current calculation by TBTrans 2018-01-30 20:40:20 UTC 2018-01-30 Yelda Kadioglu Solved
Solved 663311 a code that used in an artcle 2018-01-20 07:37:33 UTC 2018-01-20 sahar Solved
Solved 662201 How to run ex_03.py in sisl/examples ? 2017-12-25 03:20:29 UTC 2017-12-25 satoru tanibayashi Solved
Answered 661583 bad charge initialization for transiesta calculation 2017-12-11 14:58:24 UTC 2017-12-11 john Answered
Solved 661568 what is the meaning of "ts-Vha" in the log file 2017-12-11 01:34:15 UTC 2017-12-11 john Solved
Answered 661489 Compilation of Util/TS/tshs2tshs 2017-12-07 17:22:17 UTC 2017-12-07 Nspiller Answered
Answered 661373 Unfinished calculations 2017-12-03 16:06:23 UTC 2017-12-03 Pengfei Ou Answered
Answered 661150 how we can check that transiesta calculations are running in parallel 2017-11-27 16:59:45 UTC 2017-11-27 Rameshwar Lal Kumawat Answered
Solved 661111 DOS and band structure for spin up and down 2017-11-26 18:46:17 UTC 2017-11-26 Ali Jafari Solved
Solved 660804 mix: Pulay -- inversion failed, > SVD 2017-11-15 18:41:46 UTC 2017-11-15 David Guzman Solved
Solved 660773 how we can install tbtrans parallel? 2017-11-15 11:19:12 UTC 2017-11-15 Rameshwar Lal Kumawat Solved
Solved 660665 Electronic contribution to thermal conductance 2017-11-12 21:20:03 UTC 2017-11-12 David Guzman Solved
Solved 660603 using mpich to compile siesta2.0.2 2017-11-11 08:42:45 UTC 2017-11-11 chenhao Solved
Solved 660452 I-V curve dependence of device length along transport direction 2017-11-07 16:25:51 UTC 2017-11-07 Pengfei Ou Solved
Solved 660447 Transiesta could not find electrode 2017-11-07 14:22:34 UTC 2017-11-07 TamWingning Solved
Solved 660141 compilation problem of 4.1-b3 with MPI 2017-10-30 17:32:29 UTC 2017-10-30 Leonardo Fonseca Solved
Solved 660081 error while loading shared libraries: libnetcdff.so.6: cannot open shared object file: No such file or directory 2017-10-28 16:24:47 UTC 2017-10-28 Pengfei Ou Solved
Answered 659903 Calculation of interpolated currents at different bias 2017-10-24 19:51:55 UTC 2017-10-24 Pengfei Ou Answered
Solved 659629 Phonon calculation 2017-10-18 18:56:18 UTC 2017-10-18 chenhao Solved
Solved 659371 bader analyse 2017-10-13 10:16:55 UTC 2017-10-13 chenhao Solved
Answered 659345 Variable point width in TS.Contours block? 2017-10-12 16:06:46 UTC 2017-10-12 Adam Bruce Nick Papior Answered
Solved 656738 transmission in transiesta 2017-08-23 06:02:15 UTC 2017-08-23 Ali Jafari Solved
Answered 655482 Chemical Potential Input Options 2017-08-08 19:40:51 UTC 2017-08-08 Adam Bruce Answered
Answered 649149 help with atom IEEE_DENORMAL 2017-07-16 10:15:46 UTC 2017-07-16 Dayler Jhair SIlva Leiva Answered
Answered 647255 Generating formatted .rho file from Siesta 2017-07-08 23:44:37 UTC 2017-07-08 Vidushi Sharma Answered
Answered 645457 TSHS and TDSE files 2017-06-29 05:20:39 UTC 2017-06-29 Gabrielle Brown Answered
Answered 643768 nc file not created 2017-06-13 22:06:16 UTC 2017-06-13 Laszlo Oroszlany Answered
Answered 643767 hamiltonian and overlap from python 2017-06-13 21:46:30 UTC 2017-06-13 Laszlo Oroszlany Answered
Solved 642093 using ifort to compile siesta-4.1-b1 ,when calculating ,result Segment error (core dump) 2017-06-07 17:29:35 UTC 2017-06-07 chenhao Solved
Solved 640901 TRANsiesta can't find eletrode 2017-06-05 11:18:55 UTC 2017-06-05 wuwei Solved
Solved 638451 Transmission Pathways 2017-06-01 03:51:46 UTC 2017-06-01 David Guzman Nick Papior Solved
Answered 632905 example of projected transmission 2017-05-18 03:07:48 UTC 2017-05-18 john Answered
Solved 631955 Problem in SCF converge in transiesta! 2017-05-10 14:46:13 UTC 2017-05-10 Ali Jafari Solved
Solved 617153 difference between DM and SCF 2017-04-13 02:01:22 UTC 2017-04-13 kuangchungwang Solved
Answered 617055 impact of UseDomainDecomposition .true. 2017-04-12 21:25:04 UTC 2017-04-12 kuangchungwang Answered
Answered 616406 Non-converged calculations 2017-04-11 04:30:29 UTC 2017-04-11 Pengfei Ou Answered
Solved 615873 number of supercells in vibra.h 2017-04-10 11:53:28 UTC 2017-04-10 Tony Solved
Solved 615532 ERROR: Unexpected no. orbs. in L elec. 2017-04-08 01:21:47 UTC 2017-04-08 Pengfei Ou Solved
Answered 605019 about Projected transmissions 2017-04-01 15:28:16 UTC 2017-04-01 benqi Nick Papior Answered
Answered 576078 *psf relative location 2017-03-20 06:13:07 UTC 2017-03-20 kuangchungwang Answered
Answered 576071 k point for the electrode 2017-03-20 05:33:44 UTC 2017-03-20 kuangchungwang Answered
Answered 576062 parallization scheme 2017-03-20 04:53:40 UTC 2017-03-20 kuangchungwang Answered
Answered 576058 PHtrans manual 2017-03-20 02:29:35 UTC 2017-03-20 David Guzman Nick Papior Answered
Solved 566044 Sources of vdw pseudopotentials 2017-03-16 10:10:34 UTC 2017-03-16 Tony Solved
Solved 531060 Thermal Conductance or conductivity 2017-03-07 05:23:31 UTC 2017-03-07 Muhammad Ali Solved
Solved 517592 tbtrans segfault 2017-03-02 16:17:10 UTC 2017-03-02 Tim Roger Solved
Solved 515681 Transiesta stuck at Title: 'Generated GF file' 2017-03-02 13:18:21 UTC 2017-03-02 Tony Solved
Answered 482401 how can I find the SISL package? 2017-02-24 01:33:56 UTC 2017-02-24 benqi Nick Papior Answered
Answered 460594 Can transiesta give LDOS 2017-02-15 01:16:14 UTC 2017-02-15 gu tingkun Answered
Answered 451386 Can TranSiesta model heterogeneous interfaces? 2017-02-04 12:53:52 UTC 2017-02-04 Jingyang Wang Answered
Answered 446245 Basal plane of electrode 2017-01-24 05:44:54 UTC 2017-01-24 Zhenfei Liu Answered
Solved 435947 saving TSHS file as NetCDF4 format 2017-01-11 00:50:07 UTC 2017-01-11 Zhenfei Liu Nick Papior Solved
Solved 432835 Are there the forces on ions by ExternalElectricField? 2017-01-08 08:43:58 UTC 2017-01-08 Chao Lian Solved
Solved 407573 how to setup continued fraction 2016-12-18 15:47:28 UTC 2016-12-18 Yunpeng Wang Solved
Answered 406757 seg fault in tbtrans 2016-12-14 17:53:17 UTC 2016-12-14 Gaohan Miao Answered
Solved 406605 transiesta calculation with spin-orbit coupling 2016-12-10 02:45:43 UTC 2016-12-10 Yunpeng Wang Solved
Answered 403806 slab dipole correction in one-electrode TranSIESTA calculation 2016-11-04 22:19:37 UTC 2016-11-04 Zhenfei Liu Nick Papior Answered
Solved 403497 3-electrode example in TranSIESTA 2016-10-25 21:24:54 UTC 2016-10-25 Zhenfei Liu Solved
Answered 402890 Stable version of siesta 4.1 2016-10-10 03:55:38 UTC 2016-10-10 Muhammad Ali Answered
Answered 402875 how can I read Hamiltonian Matrix from .HSX file? 2016-10-09 04:24:53 UTC 2016-10-09 Siddharth Answered
Answered 375893 Transiesta Examples 2016-08-31 17:58:30 UTC 2016-08-31 Muhammad Ali Answered
Solved 374810 nano tubes and graphene 2016-08-31 06:35:51 UTC 2016-08-31 uttam Solved
Answered 371059 Problem Installing siesta 4.0 2016-08-29 17:55:12 UTC 2016-08-29 herisson Answered
Solved 366240 What is the Difference Between 4.0 SIESTA for SIESTA 3.2 ? 2016-08-26 11:31:50 UTC 2016-08-26 herisson Solved
Answered 359071 vdw in siesta 2016-08-23 16:24:29 UTC 2016-08-23 kamal Answered
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Answer contacts for Siesta