Thermodynamics and Statistical Mechanics

Chem. 2440   Spring 2003


Instructor:


Rob Coalson
rob@ringo.chem.pitt.edu
Eberly 321, (412)624-8261

Web Page:

http://mercury.chem.pitt.edu/~rob/chem2440

Student Mini-Projects:

Alvarez, Leonardo - Virial Equation for Real Gases
Bhayana, Brijesh - Bose-Einstein Condensate
Chakrabarti, Subhasis - Molecular Structure and Dynamics at Liquid-Liquid Interfaces
Essiz, Sebnem - Gaussian Network Model
Golik, Oleg - Bose-Einstein Statistics: Black-Body Radiation
Guo, Senli - Statistical Mechanical Approach to the Conformation Heat Capacity and Enthalpy of Biomolecules"
Kaur, Palwinder - Engineering of Stable and Fast-Folding Sequences of Model Proteins
Kucukkal, Mustafa - Application of 3-D Poisson-Nernst-Planck (PNP) Theory to Ion Transport Through the Gramicidin A Channel
Lu, Ying - Modern Statistical Mechanics and Protein Research
McCarthy, Valerie - Thermodynamics and Statistical Mechanics of a Group of Isomers and the Effect of a Catalyst
Ngo, An - The Debye-Huckel Theory: Calculating the Thermodynamic Properties of an Ionic Solution
Noroski, Joe - Phose Coexistence and Phose Changes in Clusters
Quivey, Scott - The Role of Statistical Mechanics in Evaluating the Miscibility of Polymers in Various Solvents
Tataurov, Andrey - Thermodynamics and Phose Behavior of Block Copolymer/Homopolymer Blends with Attractive and Repulsive Interactions
Xion, Clair - Extension of Dynamics of Granular Flow Methodology of Cell Biology
Yang, Lee - Revealing the Dynamics of Biologically Important Residues via a Normal Mode Analysis by GNM
Yue, Hongjun - Generalized Ensemble Algorithms for Molecular Simulations of Proteins
Zhang, Jian - A Model to Understand Conserved Amino Acids in Proteins
Zhang, Yi - Thermodynamic Modeling of Gas Hydrates
Zhu, Guangyu - Using Monte Carlo Simulated Annealing to Model Protein Loops

Handouts:

A primer on vibrational normal modes.

Mathcad primer.