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(1) Huckel Theory: Using Huckel theory, write a program that solves for the molecular orbitals and energy levels in a conjugated or aromatic hydrocarbon (i.e. ethylene, butadiene, etc., or benzene, cyclobutadiene, etc.). The program should accept as input, in a GUI text window, a description of the molecule (i.e., if linear, how many carbons, if aromatic, how many carbons). The algorithm will use matrix-based methods to solve simultaneous linear equations as described in any p-chem book. Output will consist of the values of the energies and molecular orbitals. Plot, in subplots, the molecular orbitals as the linear combination of 2p atomic orbitals (define your coordinate system and pick your favorite one).
Q. Show Hazards associated with plants? Hazards associated with plants will typically include the following: • Inherent fire hazards presented by the release of flammable g
Arm of Couple: Explain couple and Arm of couple? Sol.: If the two equal and opposite parallel forces (that is equal and unlike) are acting on a body, they do not have a
A tensile test on a specimen having an initial diameter of 13.11 mm and an initial gauge length of 200.0 mm, gave the following data:
A semi circular frame of flexural rigidity EI is built at A and caries a vertical load W at B. calculate the magnitude of the vertical and horizontal deflection at B and hence the
What is heat treatment and why is it done? Heat treatment can be described as a combination of operations or processes in which cooling and heating of an alloy or metal is done
The Brasses 70/30 brass also called as cartridge brass contains 70% copper and 30% Zinc. This is employed for cartridge cases, sheet fabrication, and condenser tubes and for u
Consider a car of mass m1 is towing a trailer of mass m2 through a tow bar of stiffness k. Drag forces proportional to the car velocity (b1 v1) and the trailer velocity (b2 v2) a
Q. What do you mean by Stage Discharge Relationship? Regular recording of discharges over a period of time is essential for estimation of water resources of river basins and su
Illustrate what is meant by volumetric efficiency of a compressor ? Illustrate how clearance volume affects it. Discuss the effects of clearance volume on the performance of an air
Ask . A vessel having a volume of 0.6 m3 contains 3.0 kg of liquid water and water vapour mixture in equilibrium at a pressure of 0.5 MPa. Calculate : (i) Mass and volume of liquid
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