Physical Chemistry
Physical Chemistry
2nd Edition
ISBN: 9781133958437
Author: Ball, David W. (david Warren), BAER, Tomas
Publisher: Wadsworth Cengage Learning,
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Chapter 12, Problem 12.54E
Interpretation Introduction

Interpretation:

Between the given diatomic molecules H2 and Cs2, the one for which Born-Oppenheimer approximation is likely to introduce less error is to be identified. The reason for the same is to be stated.

Concept introduction:

The Born-Oppenheimer approximation describes the quantum state of the molecules. It stated that the motion of a nucleus and the motion of an electron in a molecule can be separated. The Schrödinger equation is solved by using the above mathematically expression for the given molecular wavefunction.

The Schrödinger equation is used to find the allowed energy levels for electronic transitions in the quantum mechanics. It is generally expressed as follows.

HΨ=EΨ

Where,

His the Hamiltonian operator.

Ψis the wavefunction.

E is the energy

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Consider the molecules: CH2=CH-CH=CH-CH=CH-CH=CH-CH=CH2. Let’s assume that the 10 electrons that make up the double bonds can exist everywhere along the carbon chains. The electrons can then be considered as particles in a box; the ends of the molecule correspond to the boundaries of the box with a finite or zero potential energy inside. In this “molecular box”, 2 electrons can occupy an energy level. What are quantum states that the electrons from this molecule can occupy in the ground state? Note that the length of a C-C bond is about 1.54A and the length of a C=C bond is 1.34A to allow you to estimate the length of the “molecular box”
Consider the molecules: CH2=CH-CH=CH-CH=CH-CH=CH-CH=CH2. let’s assume that the 10 electrons that make up the double bonds can exist everywhere along the carbon chains. The electrons can then be considered as particles in a box; the ends of the molecule correspond to the boundaries of the box with a finite or zero potential energy inside. In this “molecular box”, 2 electrons can occupy an energy level. What are quantum states that the electrons from this molecule can occupy in the ground state? What’s the smallest frequency of light that can excite the electron? Briefly explain why. Note that the length of a C-C bond is about 1.54A and the length of a C=C bond is 1.34A to allow you to estimate the length of the “molecular box”
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Chapter 12 Solutions

Physical Chemistry

Ch. 12 - Draw a diagram analogous to Figure 11.15, but now...Ch. 12 - Are mathematical expressions for the following...Ch. 12 - Prob. 12.13ECh. 12 - Prob. 12.14ECh. 12 - a Assume that the electronic energy of Li was a...Ch. 12 - Spin orbitals are products of spatial and spin...Ch. 12 - If 1 and 2 are the individual wavefunctions for...Ch. 12 - Show that the correct behavior of a wavefunction...Ch. 12 - Prob. 12.19ECh. 12 - Why isnt the electron configuration of beryllium,...Ch. 12 - Prob. 12.21ECh. 12 - Write a Slater determinant for the lithide ion,...Ch. 12 - Why does the concept of antisymmetric...Ch. 12 - a Construct Slater determinant wavefunctions for...Ch. 12 - Prob. 12.25ECh. 12 - Prob. 12.26ECh. 12 - Prob. 12.27ECh. 12 - Suppose an electron had three possible values of...Ch. 12 - Using a periodic table or Table 12.1, find the...Ch. 12 - Write an acceptable electron configuration for...Ch. 12 - Prob. 12.31ECh. 12 - Prob. 12.32ECh. 12 - Prob. 12.33ECh. 12 - An anharmonic oscillator has the potential...Ch. 12 - Prob. 12.35ECh. 12 - In a particle-in-a-box having length a, the...Ch. 12 - Prob. 12.37ECh. 12 - Prob. 12.38ECh. 12 - Prob. 12.39ECh. 12 - The Stark effect is the change in energy of a...Ch. 12 - Prob. 12.41ECh. 12 - Prob. 12.42ECh. 12 - Prob. 12.43ECh. 12 - Show that a variation theory treatment of H using...Ch. 12 - Prob. 12.45ECh. 12 - Explain why assuming an effective nuclear charge,...Ch. 12 - Prob. 12.47ECh. 12 - Consider a real system. Assume that a real...Ch. 12 - Prob. 12.49ECh. 12 - Prob. 12.50ECh. 12 - Prob. 12.51ECh. 12 - Prob. 12.52ECh. 12 - State the Born-Oppenheimer approximation in words...Ch. 12 - Prob. 12.54ECh. 12 - Spectroscopy deals with differences in energy...Ch. 12 - Prob. 12.56ECh. 12 - What is the bond order for the lowest excited...Ch. 12 - The helium atom was defined as two electrons and a...Ch. 12 - Explain how we know that the first in equation...Ch. 12 - Prob. 12.60ECh. 12 - Prob. 12.61ECh. 12 - Use molecular orbital arguments to decide whether...Ch. 12 - Prob. 12.63ECh. 12 - Prob. 12.65ECh. 12 - Prob. 12.67ECh. 12 - Prob. 12.68E
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