Distance between atoms - Minimum energy

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SUMMARY

The discussion centers on calculating the effective potential between two atoms of the same mass, described by the equation V(x) = -a/x + b/x², where a and b are positive constants. Participants explore the minimum distance between atoms and the corresponding minimum energy, emphasizing the use of uncertainty principles and the Schrödinger Equation. Key insights include approximating the potential around its minimum using a parabolic function to estimate energy levels. The conversation also touches on the implications of varying parameters a and b in the potential function.

PREREQUISITES
  • Understanding of Quantum Mechanics principles, particularly the Schrödinger Equation.
  • Familiarity with potential energy functions and their behavior.
  • Knowledge of uncertainty principles in quantum physics.
  • Basic calculus skills for finding minima of functions.
NEXT STEPS
  • Study the derivation and implications of the Schrödinger Equation in quantum systems.
  • Learn about potential energy approximations, particularly using Taylor series expansions.
  • Explore the concept of harmonic oscillators in quantum mechanics for energy level estimations.
  • Investigate the effects of varying parameters in potential energy functions on molecular stability.
USEFUL FOR

Students in Quantum Mechanics, physicists analyzing atomic interactions, and researchers studying molecular dynamics and potential energy landscapes.

mgal95
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Homework Statement


The effective potential between two atoms of same mass m is:
V(x)=-a\frac{1}{x}+b\frac{1}{x^2}
where a,b>0 and x is the distance between them.
(a) Calculate (order of magnitude) the distance between the two atoms in the molecule and its minimum possible energy.
(b) Compare the minimum energy with the minimum potential energy. Could we have a=0 and b<0?
(c) Can a molecule with V(x)=-\frac{|b|}{x^{2n}} , 1\leq n exist?

Homework Equations


This is a problem given in the finals of a third year Quantum Mechanics class at my University. I suppose that all is needed are the uncertainty inequalities, since I do not even know if the corresponding Schroedinger Equation has an analytic solution (let alone find it).

The Attempt at a Solution


I do not even know where to start from. Some ideas:
\left< E\right>=\left< H\right>=\frac{\left<p_1^2 \right>}{2m} + \frac{\left<p_2^2 \right>}{2m} +\left< V\right>
\Delta p\Delta x\geq \hbar/2
\left(\Delta p\right)^2=\left< p^2\right>-\left< p\right>^2
Thus:
\left<p^2 \right>\geq \left(\Delta p\right)^2\geq \frac{\hbar}{2\left(\Delta x\right)^2}
and then
\left< E\right>\geq \frac{\hbar}{\left(\Delta x\right)^2} -a\left< \frac{1}{x}\right>+b\left<\frac{1}{x^2} \right>
My idea now is to form the right part of the last inequality in a function f=f(\Delta x). Then I can find the minimum of this function equating the derivative with zero. Then the equality would give me the minimum energy. The value of \Delta x that I will get will be in the order of magnitude of the distance between the atoms. Since nature prefers minimum energy states, the minimum energy would be the ground state and thus I can assume \Delta x\simeq x The problem is that I cannot form such a function for this potential. On the other hand, I can do this for the potential given in (c), since -b\left< x^{-2n}\right> \geq -b\left(\Delta x\right)^{-2n} (proven using the definition of the uncertainty).
Another idea for the distance is to calculate \left< x\right>, but I do not have a clue how to do that.

Please excuse my English
Thank you
 
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I think you are overthinking this. To get an order of magnitude estimate, you can approximate the potential around the minimum by a parabola, and you should know how the energy levels look there.
 

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