Name | Modified | Size | Downloads / Week |
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README | 2012-11-29 | 1.6 kB |
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feram-0.19.08.tar.xz | 2012-11-29 | 14.9 MB | |
Totals: 2 Items | 14.9 MB | 0 |
Dear current and future feram users, I released feram-0.19.08.tar.xz from http://sourceforge.net/projects/loto/files/feram/ . "feram" is a fast molecular dynamics (MD) simulator for bulk and thin-film ferroelectrics. Its homepage is http://loto.sourceforge.net/feram/ . This version 0.19.08 contains bug-fixed src/coord_module.F. With this fix, feram will write the whole system, not half of the system, into .coord files, when bulk_or_film = 'film' or 'epit'. Now, you can perform cooling-down and heating-up simulations of films. See src/17example-PbTiO3-100-900K/coolflm.sh and src/17example-PbTiO3-100-900K/heatflm.sh. From the version 0.19.07, a new tag "distribution_directory" is introduced to control .distribution and .distribution3d output files. You can use distribution3d2ppm command for visualization of 3-dimensional distribution of dipole vector u. See README.en, README.ja, average_module.F and distribution3d2ppm.F. From the version 0.19.06, a new tag "coord_directory" is introduced. It controls the directory into which .coord files will be stored. From the version 0.19.05, FFTW_MEASURE is used for the FFTW Planner Flag instead of FFTW_PATIENT. For more details, $ grep FFTW_MEASURE src/coord_module.F and see http://www.fftw.org/doc/Planner-Flags.html . Use fft_check to boost up your calculations. From the version 0.19.05, You cannot compile feram with OFORT90 (Hitachi Fortran). Use xlf90_r (IBM XL Fortran) for SR16000. From the version 0.19.04, feram tries to import 'wisdom' file from current directory or /etc/fftw/wisdom. Enjoy, -- Takeshi