Finding the Equilibrium Separation in a Diatomic Molecule: A Scientific Approach

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SUMMARY

The discussion focuses on determining the equilibrium separation in a diatomic molecule, represented by the potential energy equation U = (A/r^12) - (B/r^6). The force between the atoms is derived from the potential energy function, leading to the equation F(x) = (12A/r^13) + (6B/r^7). The equilibrium separation is found by setting the force to zero, resulting in the formula r = (2A/B)^(1/6). The analysis also concludes that if the separation is larger than the equilibrium, the force is negative (attractive), while if it is smaller, the force is positive (repulsive).

PREREQUISITES
  • Understanding of potential energy functions in physics
  • Familiarity with calculus, specifically differentiation
  • Knowledge of diatomic molecular structures
  • Basic grasp of force and equilibrium concepts
NEXT STEPS
  • Study the implications of potential energy graphs for diatomic molecules
  • Learn about the physical significance of equilibrium separation in molecular interactions
  • Explore the role of constants A and B in molecular potential energy equations
  • Investigate the effects of varying atomic separation on molecular forces
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Students and professionals in physics, chemistry, and materials science who are studying molecular interactions and potential energy concepts.

Ginny Mac
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Oh boy...this problem has stumped me. I am not even sure I know where to start:

The potential energy of a diatomic molecule (a two-atom system like H2 or O2) is given by
U= (A/r^12) - (B/r^6)

where r is the separation of the two atoms of the molecule and A and B are positive constants. This potential energy is associated with the force that binds the two atoms together.
(a) Find the equilibrium separation - that is, the distance between the atoms at which the force on each atom is zero. Is the force repulsive (atoms are pushed apart) or attractive (atoms are pulled together) if their separation is (b) smaller and (c) larger than the equilibrium separation?

Okay. I started out thinking that because we are looking for the force, we would need to use F(x) = - (d/dx)(U(x)), and after differentiation

F(x) = (12A/r^13) + (6B/r^7)

So here is the big "now what?" Please help. Thank you - any help is greatly appreciated.
~Gin
 
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Ginny Mac said:
(a) Find the equilibrium separation - that is, the distance between the atoms at which the force on each atom is zero.
[snip]

Okay. I started out thinking that because we are looking for the force, we would need to use F(x) = - (d/dx)(U(x)), and after differentiation

F(x) = (12A/r^13) + (6B/r^7)

So here is the big "now what?" Please help. Thank you - any help is greatly appreciated.
~Gin

You have the next step: you said "Find ... the distance between the atoms at which the force on each atom is zero." (that is, find the value of r that makes F=0)
 
okay...but there are three unknowns in my equation... Is there a step I am leaving out?? Even solving algebraically only reduces down to 2A-Br^6 = 0. Does something cancel out that I am not aware of? Or maybe we are supposed to be left with an equation?
 
You are told "A and B are positive constants". So, you can expect that your answer is in terms of those positive [but otherwise unspecified] constants.
 
Ahhh...so I got my equation down to (2A/B)^(1/6) = r. So that value of r is the equilibrium separation. Now for the next part, figuring out atomic behaviors based on larger/smaller values in relation to equilibrium sep. This should be interesting.

Equation: 2A-Br^6=0

If sep. is larger than equilibrium, we should have a negative force, and if it is smaller than eq., we should have a positive force. I think a negative force will draw the atoms together (?) Any thoughts are appreciated. Thank ya'll.

gin
 
Can you sketch the potential energy function U= (A/r^12) - (B/r^6) vs separation r, and locate your special value of r?
 

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