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Sorry I was trying to post this to the "Feature suggestion/request" site on gromacs mailserver, however this has been changed in recent months. I thus do not know how to post such a thing now without joining the developer mail site (I would at present not be such a person, and would not like to see such a thing bogged down with user help mails/spam).
I was just attempting to run this by some developers. In the past two years I have run into several materials based work which would benifit from electric currents, or electomagnetic fields (external broad range in setting). In the recent science there was a nice piece about this applied to liquid droplets with particles, or doped secoundary chemistry (oils, polymers, complex small molecule/metal adducts and/or nano bead polymers...), which primarily work through external magnetic field altering the surface chemistry, and retaining the effects after fields are removed. This can also be applied to electromagentic induced crystalization at atomic level, multi layered liquid interfaces...etc.
In any case this might be an area where simulations would play a large part if effects from external fields, or even free electrons (currents applied in layers, surfaces or the entire unit cell) could be modeled sufficiently. Meaning probably a good lab funding source and interesting work.
Sorry about any spelling areas.
Sincerely,
Stephan Watkins, (now PhDd)
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