A thermodynamics polymer chain problem

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SUMMARY

The discussion centers on a thermodynamics problem involving a one-dimensional polymer molecule, specifically rubber, modeled as a chain of N links of length a. The interaction of the polymer with an electric field and two charges at its ends leads to a total electrostatic energy defined by the equation E=−q\mathcal{E} (x_N −x_0). The challenge lies in determining the dependence of temperature on the distance L between the ends of the molecule, particularly how the polymer contracts with increasing temperature. The partition function Z is derived, but participants express difficulty in calculating the mean length of the polymer chain and its behavior under thermal conditions.

PREREQUISITES
  • Understanding of polymer physics and thermodynamics principles
  • Familiarity with statistical mechanics concepts, including partition functions
  • Knowledge of electrostatics, particularly the behavior of electric charges in fields
  • Basic calculus and mathematical modeling skills for energy and entropy calculations
NEXT STEPS
  • Study the derivation and application of the partition function in statistical mechanics
  • Explore the relationship between energy, entropy, and temperature in thermodynamic systems
  • Investigate Gibbs free energy and its implications for polymer behavior under varying conditions
  • Examine case studies on polymer contraction in response to temperature changes
USEFUL FOR

This discussion is beneficial for physicists, materials scientists, and engineers working with polymers, as well as students studying thermodynamics and statistical mechanics. It provides insights into the complex interactions between thermal energy and polymer behavior.

chemicaholic
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A one-dimensional polymer molecule (rubber) is chain of N links of the same length a, the links can go either forward or backward but always stay parallel to the x axis. If one denotes the coordinates of the joints are ${x_0, x_1, . . . , x_N}$ , then $|x_n − x_{n+1}| = a$. The energy of the polymer does not depend on the angles at the joints.

Two electric charges $-q$ and $q$ are attached to the two ends of the molecule. An electric field $\mathcal{E}$ is turned on. The total energy of the molecule is the electrostatic energy,
$$E=−q\mathcal{E} (x_N −x_0)$$
Find the dependence of the temperature on the distance $L$ between the two ends of the molecule. Imagine the system interacts with a thermal bath, show that the rubber molecule contracts when the temperature increases.

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So I tried this problem with first setting up energy states, with $E_n = -qE(x_N - x_0) = -qE(-N+2n)a$, and getting the partition function $$Z = \frac{e^{-\beta q \mathcal{E} N a} - e^{\beta q \mathcal{E} N a}}{1-e^{2\beta q \mathcal{E} a}}$$
but I don't know how to proceed from here. In principle I should take $\langle L \rangle = \frac{1}{Z}\sum_{n=0}^N e^{-\beta E_n} |x_N - x_0|$, but the expression is extremely complicated and there is no way to answer the second question (that the polymer contracts when temperature increases).
Could anyone help me?
 
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Finding the mean length of a polymer chain in the absence of charges involves maximizing the entropy. I imagine that your problem involves some combination of energy and entropy (Gibbs?).
 

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