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Chem.412 – PChem I - Outline Introduction/Basics Review Computer Applications States of Matter First Law of TDMolecular Energies Equilibrium & Spontaneity Quantum Chemistry Entropy – 2 nd /3 rd Laws Equations of State
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Introduction: Review of Basics Four Major Principles Mathematical Basics Units Significant Figures. Problem Solving Common Terminology Factor Labels
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States of Matter Equations of State Ideal GasDeviations Van der WaalsVirial Series Kinetic Molecular Model Corresponding States Fluids Reduced Variables Condensed Phases Berth., R-K Mixtures
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Chem.412 – Molecular Energies
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Equipartition of Energy Motions Linear Molecule Energy per DOF Non-Linear Molecule DOFEnergyDOFEnergy Translational3(3/2)kT(1/2)kT3(3/2)kT Rotational2kT(1/2)kT3(3/2)kT Vibrational3N-5(3N-5)kTkT3N-6(3N-6)kT
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A = U - TSG = H - TS If A sys < 0, rxn spontaneous. (Constant V & T) If G sys < 0, rxn spontaneous. (Constant P & T) dA = -PdV – SdTdG = VdP - SdT
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Chem.412 – PChem I - Outline Introduction/Basics Review Computer Applications States of Matter First Law of TDMolecular Energies Equilibrium & Spontaneity Quantum Chemistry Entropy – 2 nd /3 rd Laws Equations of State
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