. The π-electrons of naphthalene(C10H8) can be considered to be confined to a rectangular box of dimension 4 A by 7 A (particle-in-a-box)
1) set up and solve the Schrodinger equation to find the energy levels.
2) Add the electrons to the energy-level diagram
3) which levels correspond to HOMO and LUMO? at what wavelength will the lowest energy transition occur?
. The π-electrons of naphthalene(C10H8) can be considered to be confined to a rectangular box of dimension 4 A by 7 A (particle-in-a-box) 1) set up and solve the Schrodinger equation to find the energ...
The π-electrons of naphthalene(C10H8) can be considered to be confined to a rectangular box of dimension 4 A by 7 A (particle-in-a-box) 1) set up and solve the Schrodinger equation to find the energy levels. 2) Add the electrons to the energy-level diagram 3) which levels correspond to HOMO and LUMO? at what wavelength will the lowest energy transition occur?
Problem 1 Assume r-electrons in benzene can be modelled according to a 2D particle in box model. The box can be assumed square with the side of 5 Angstrom. Assume each C atom contributes only 1 electron. a) Sketch qualitatively the energy levels diagram for the up to 5 energy states (count degenerate states as one). b) Compute the HOMO-LUMO gap [in eV. c) How much do the conclusions above would change if we assume a non-zero thickness (e.g. 0.5...
Problem 1 Assume m-electrons in benzene can be modelled according to a 2D particle in box model. The box can be assumed square with the side of 5 Angstrom. Assume each C atom contributes only 1 electron a) Sketch qualitatively the energy levels diagram for the up to 5 energy states (count degenerate states as one). b) Compute the HOMO-LUMO gap [in eV] c) How much do the conclusions above would change if we assume a non-zero thickness (e.g.0.5 Angstrom)...
Question # 1: Find the unit of energy in the energy expression of a free particle in 1-D box: Question # 2: A proton in a box is in a state n = 5 falls to a state n = 4 and loose energy with a wavelength of 2000 nm, what is the length of the box? (answer: 4 x 10 m) Question # 3: a. Consider an electron confined to move in an atom in one dimension over a...