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| From: | Kai Grass |
| Subject: | [ESPResSo-devel] Particle property q |
| Date: | Mon, 2 Jul 2007 21:37:57 -0400 |
| Hi another time, (no, it is not 3:30 at night, don't worry) while extending the description for the "part" command in the user guide, I noticed, that Espresso doesn't complain if the charge q is set, even though ELECTROSTATICS is not compiled in. The command issued is simply silently surpressed in set_particle_q() [communication.c]. Similarly, polymer, salt and counterions allow to specify q in those cases. While this shouldn't lead to any problems since Coulomb interactions cannot be setup without ELECTROSTATICS, it still feels inconsistent to me. At least a warning should be issued in these cases. Greetings, Kai -- Dipl. Phys. Kai Grass (current coordinates) Department of Physics University of Ottawa 150 Louis-Pasteur Ottawa, Ontario K1N 6N5 Canada phone: +1 613 562 5800 x6937 fax: +1 613 562 5190 -- Frankfurt Institute for Advanced Studies (FIAS) Max-von-Laue-Strasse 1 60438 Frankfurt am Main Germany phone: +49 69 798 47533 fax: +49 69 798 47611 mail: address@hidden |
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