Zero-point energy of diatomic hydrogen (particle in a box)

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SUMMARY

The zero-point energy of diatomic hydrogen (H2) can be calculated as the sum of the zero-point energies of its constituent particles, specifically the protons (H+) and electrons (e-). The formula derived is $$E_{1,H_2}=\frac{h^2}{4L^2}(1/m_{\mathrm{H^+}}+1/m_{\mathrm{e^-}})$$, indicating that the energy is dependent on the masses of the particles and the dimensions of the box (L). The discussion emphasizes the importance of considering "ortho-para" equilibrium when calculating the ground state energy of hydrogen molecules in an isolated system.

PREREQUISITES
  • Understanding of quantum mechanics and zero-point energy
  • Familiarity with the concept of particles in a box model
  • Knowledge of bosons and their statistical behavior
  • Basic principles of chemical bonding in diatomic molecules
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  • Explore the implications of "ortho-para" equilibrium in diatomic hydrogen
  • Study the particle in a box model in greater detail
  • Investigate the effects of confinement on quantum systems
  • Learn about the applications of zero-point energy in quantum mechanics
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Physicists, chemists, and students studying quantum mechanics, particularly those interested in molecular behavior and energy calculations in confined systems.

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Homework Statement
Can the zero-point energy of diatomic hydrogen be calculated as a sum of the zero-point energies of all particles in the system?
Relevant Equations
##E_1 = h^2/8mL^2##
If we take ##H_2## as a "particle" in a box, can the zero-point energy of the overall molecule be calculated as the sum of the zero-point energies of all particles in ##H_2##?

That is $$E_ {1,H_2}=\frac{2h^2}{8m_{\mathrm{H^+}}L^2} + \frac{2h^2}{8m_{\mathrm{e^-}}L^2}= \frac{h^2}{4L^2}(1/m_{\mathrm{H^+}}+1/m_{\mathrm{e^-}})$$

My reasoning being that in our "ideal" box, the system is isolated, and thus energy must be conserved.
 
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One hydrogen molecule, two protons and two electrons system, has its ground state for chemical bond.
Say hydrogen molecules are in a box, since they are Bose particles, all remain in the ground state for molecule motion.
The ground state energy of hydrogen molecules in a box seems to be decomposed like that.
 
You may want to consider the "ortho-para" equilibrium for "ground state" calculations.
 
Bystander said:
You may want to consider the "ortho-para" equilibrium for "ground state" calculations.
Explain?
 

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