Electric Dipoles: Properties and Potential Solutions

AI Thread Summary
The discussion centers on the behavior and properties of a gas of randomly oriented electric dipoles, emphasizing the challenges in describing their interactions without relying on large volume approximations. Participants explore the complexities of induced dipole interactions and the potential for numerical solutions, noting that most molecular simulations overlook these effects due to their difficulty. A semi-ideal gas model is suggested as a simpler approach, accounting for translational, rotational, and vibrational degrees of freedom. The conversation also touches on potential energy calculations between dipoles and point charges, with references to relevant literature for further understanding. Overall, the topic highlights the intricate nature of many-body problems in dipole systems and the need for advanced methods to analyze them.
Schrodu
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Suppose we have a gas of randomly oriented (and in random motion) electric dipoles. Obviously the dipoles do not behave as free particles. How do we describe it's properties? Can we define potential etc. ?
I am looking for a solution without the large volume approximation. Is it possible to get an expression for the mean kinetic energy etc. of a particle given its total energy?
 
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will get some answers here shreyas.
though i strictly believe this isseroius mixture of eveidence and thermodynamic arguements
 
you are talking about a truly many-body problem, where you must (usually) include the induced dipole-induced dipole interactions. if they don't matter, then why bother?

there are ways of doing this numerically, but they are difficult. you can start with an analytic expression by considering a dipole, mu=dq, interacting with a point charge, you'll then get

<br /> \nabla_\alpha \nabla_\beta \frac{1}{r}<br />

as the induced field contribution, which needs to be solved for numerically for anything but the simplest of systems. that's why most molecular simulation techniques ignore induced dipoles.
 
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quetzalcoatl9 said:
there are ways of doing this numerically, but they are difficult. you can start with an analytic expression by considering a dipole, mu=dq, interacting with a point charge, you'll then get

<br /> \nabla_\alpha \nabla_\beta \frac{1}{r}<br />

.
Could you clarify that a bit? I am not used to the standard notations. In my original attempt, I calculated the potential energy of two interacting dipoles in terms of their spacing and orientation. I want to average this out in some way (integrating over the angle obviosly gives net potential energy 0)

Thanks for the help.
 
If you're looking for a simple solution, the only viable one is to treat it like a semi-ideal gas. The dipoles have translational, rotational and vibrational degrees of freedom, each of which is 1/2 kT per molecule in this simple approximation.
 
Schrodu said:
Could you clarify that a bit? I am not used to the standard notations. In my original attempt, I calculated the potential energy of two interacting dipoles in terms of their spacing and orientation. I want to average this out in some way (integrating over the angle obviosly gives net potential energy 0)

Thanks for the help.

the potential energy of interaction between a dipole and a point charge (if you draw out the two charges seperated) that is far away is \nabla_a (\frac{1}{r})

since E = -\nabla V then the dipoles contribution to the induced field is the expression i gave.

do a scholar google search for "molecular polarization" if you are more interested. there are review articles out there that summarize the field. also, Jackson's E&M book may interest you.
 
I found in this paper(page no. 4)

dipole field E=\frac{\mu}{4\pi \epsilon_0 r^3} ...
... \frac{mv_w^2(r)}{2}=kT-(\frac{\mu_r^2}{4\pi \epsilon_0})(\frac{1}{d^3}-\frac{1}{r^3})
Shouldn't there be a term to take care of direction, U=\frac{\mu_r^2\cos\alpha}{4\pi \epsilon_0}?, \alpha is angle between field and the axis
 
You can also consider a mean field approximation -- that will allow you to calculate the potential energy due to the orientation of the dipoles. In fact, with that approximation, I guess you'd get a hybrid free-gas / Curie ferromagnet effect, with a phase change due to the orientation. As far as dipole-dipole forces beyond merely torque, perhaps use the Van de Waals approximation?
 
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