Please supply this: gcc --version gfortran --version And ldd /home/ganesh/.local/lib/python2.7/site-packages/Inelastica/F90helpers.so
2015-04-23 22:43 GMT+02:00 ganesh sivaraman <[email protected]>: > Hi Nick, > > Please find the attachment for the same . I have included both building > and install . > > On Thu, Apr 23, 2015 at 10:25 PM, Nick Papior Andersen < > [email protected]> wrote: > >> There should be another error message associated with the python >> installation. >> Please provide that. >> >> I.e. try and reinstall inelastica, but pipe the output (plus stderr) to a >> file and send that file. >> >> To pipe stderr to stdout do: >> python setup.py install 2>&1 > debug.out >> >> >> >> 2015-04-23 22:18 GMT+02:00 ganesh sivaraman <[email protected]>: >> >>> Hi, >>> >>> I have this strange error . I don't quiet understand it . Isee that new >>> pyTBT has pdos capability. But when i changed to the latest snapshot of >>> inelastic i have started to get the following error. >>> >>> Problems encountered with F90helpers.so >>> >>> Falling back on a pure python (slower) implementation >>> >>> Try compiling manually following these steps: >>> >>> $ cd Inelastica/package/F90 >>> >>> $ source compile.bat (or compile_alternative.bat) >>> >>> $ cp F90helpers.so <python>/site-packages/Inelastica/ >>> >>> >>> >>> >>> I went to this folder and completed this procedure and placed the two >>> files in right path and sourced then. still it does not go away . Plus i >>> have lapack and boas routines that compiled well for siesta . This is >>> rather weird. >>> >>> Any hints ? >>> >>> >>> >>> On Wed, Apr 22, 2015 at 10:51 PM, ganesh sivaraman < >>> [email protected]> wrote: >>> >>>> Thanks all. I will try >>>> >>>> On Tue, Apr 21, 2015 at 8:54 PM, Magnus Paulsson < >>>> [email protected]> wrote: >>>> >>>>> Try: >>>>> pyTBT —help >>>>> >>>>> (SVN-version of Inelastica) >>>>> >>>>> This is the python version of tbtrans. Thomas has added a lot of >>>>> PDOS calculations and the output files should >>>>> be directly readable by xmgrace. I haven’t looked at PDOS myself so I >>>>> don’t remember the details. >>>>> >>>>> -Magnus >>>>> >>>>> ----------------------------------------------- >>>>> Magnus Paulsson >>>>> Assistant Professor >>>>> Dept. of Physics and Electrical Engineering >>>>> Linnaeus University >>>>> Phone: +46-480-446308 >>>>> Mobile: +46-70-6942987 >>>>> >>>>> On 21 Apr 2015, at 18:46, ganesh sivaraman <[email protected]> >>>>> wrote: >>>>> >>>>> Hi Nick , >>>>> >>>>> I am quiet familiar with EIgenchannels tools and --help for that was >>>>> always helpful . Inelastica does say its for IETS. There are some flags >>>>> similar to eingenchannels , when i tried the --help for inelastic . But i >>>>> was not quiet sure about outputs. Its rather confusing unlike >>>>> eigenchannels . >>>>> >>>>> Even some publications using this would have been very helpful . >>>>> Please let me know >>>>> >>>>> >>>>> On Tue, Apr 21, 2015 at 11:16 AM, Nick Papior Andersen < >>>>> [email protected]> wrote: >>>>> >>>>>> Have you tried using the --help flag on the commands in Inelastica? >>>>>> They are actually pretty helpful. >>>>>> >>>>>> 2015-04-21 9:40 GMT+02:00 ganesh sivaraman <[email protected]>: >>>>>> >>>>>>> Hi, >>>>>>> >>>>>>> I saw that Inelastica has the capability of give PDOS . Does any >>>>>>> one have experience how to do this ? >>>>>>> >>>>>>> T&R, >>>>>>> >>>>>>> Ganesh Sivaraman >>>>>>> >>>>>> >>>>>> >>>>>> >>>>>> -- >>>>>> Kind regards Nick >>>>>> >>>>> >>>>> >>>>> >>>> >>> >> >> >> -- >> Kind regards Nick >> > > -- Kind regards Nick
