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Student Presentations
[1]
Pedersen, R.D.; Stubbs, J.M. `Molecular simulations of DNA
hybridization and melting using a coarse-grained model', Fifth Midwest
Undergraduate Computational Chemistry Consortium Conference, Minneapolis,
MN (7/2005)
[2]
Peters, J.F.; Stubbs, J.M. `Optimizing extraction of ethyl benzene
from poly(ethylene glycol) using supercritical carbon dioxide: A Monte
Carlo study', Fifth Midwest
Undergraduate Computational Chemistry Consortium Conference, Minneapolis,
MN (7/2005)
Presentations
[1] Stubbs, J.M.; Siepmann, J.I. `Monte Carlo simulations of 1-hexanol in
n-hexane: The formation of hydrogen-bonded clusters in n-hexane rich
solution', 33rd Midwest Theoretical Chemistry Conference, Iowa City,
IA (5/2000)
[2]
Stubbs, J.M.; Siepmann, J.I. `Monte Carlo calculations for the
aggregation of alkanols in nonpolar solvents', 2001 Midwest
Thermodynamics & Statistical Mechanics Conference, East Lansing, MI
(5/2001)
[3]
Stubbs, J.M. `Monte Carlo simulations of 1-hexanol in n-hexane: The
formation of hydrogen-bonded clusters in n-hexane rich solution',
Theoretisch-Chemisches Seminar, Lehrstuhl für Theoretische Chemie,
Ruhr-Universität Bochum, Bochum, Germany (10/2001)
[4]
Stubbs, J.M.; Siepmann, J.I.; Wick, C.D.; Zhuravlev, N.D.
`Predicting phase equilibria using configurational-bias Monte Carlo
simulations in the Gibbs ensemble', 2002 AIChE Annual Meeting, Session
on `Obtaining physical and chemical properties for process design by
computational chemistry', Indianapolis, IN (11/2002)
[5]
Stubbs, J.M.; Siepmann, J.I. `Aggregation of hexanol isomers in
n-hexane', 2003 Midwest Thermodynamics & Statistical Mechanics
Conference, Columbus, OH (5/2003)
[6]
Stubbs, J.M.; Siepmann, J.I. `Aggregation of hexanol isomers and of
2-ethoxyethanol in n-hexane', 226th ACS National Meeting, New
York, NY (9/2003)
[7]
Stubbs, J.M.; Siepmann, J.I. `Vibrational spectra of 1-hexanol in
n-hexane via ab initio molecular dynamics', 226th ACS National
Meeting, New York, NY (9/2003)
[8]
Stubbs, J.M.; Siepmann, J.I.; Wick, C.D.; Zhang, L.; Potoff, J.
`Extension of the TraPPE force field to nitrogen functionalities',
2003 AIChE Annual Meeting, Session on `Development and validation of
intermolecular potential functions I', San Francisco, CA (11/2003)
[9]
Stubbs, J.M.; Siepmann, J.I.
`Aggregation of hexanol isomers and of 2-alkoxyethanols in n-hexane:
Aggregation, steric hindrance, inter- and intramolecular hydrogen bonding
and vibrational spectroscopy', Poster,
Tenth International Conference on Properties and Phase Equilibria for
Product and Process Design,
Snowbird, UT (5/2004)
[10]
Stubbs, J.M.; Siepmann, J.I.
`Vibrational spectra of 1-hexanol in n-hexane
using a multiscale modeling approach',
2004 Midwest Thermodynamics & Statistical Mechanics Conference,
Buffalo, NY (6/2004)
[11]
Stubbs, J.M.; Siepmann, J.I.
`Interfacial properties of aqueous surfactant mixtures: A Monte Carlo study',
231st ACS National Meeting,
Atlanta, GA (3/2006)
[12]
Stubbs, J.M.; Tito, N.B.
`Modeling heterogeneous melting equilibria of surface-immobilized DNA
using Monte Carlo molecular simulation',
2009 Midwest Thermodynamics & Statistical Mechanics Conference,
Detroit, MI (5/2009)
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