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# User Rev Content
1 chrisfen 743 \begin{thebibliography}{29}
2     \expandafter\ifx\csname natexlab\endcsname\relax\def\natexlab#1{#1}\fi
3     \expandafter\ifx\csname bibnamefont\endcsname\relax
4     \def\bibnamefont#1{#1}\fi
5     \expandafter\ifx\csname bibfnamefont\endcsname\relax
6     \def\bibfnamefont#1{#1}\fi
7     \expandafter\ifx\csname citenamefont\endcsname\relax
8     \def\citenamefont#1{#1}\fi
9     \expandafter\ifx\csname url\endcsname\relax
10     \def\url#1{\texttt{#1}}\fi
11     \expandafter\ifx\csname urlprefix\endcsname\relax\def\urlprefix{URL }\fi
12     \providecommand{\bibinfo}[2]{#2}
13     \providecommand{\eprint}[2][]{\url{#2}}
14    
15     \bibitem[{\citenamefont{Jorgensen et~al.}(1983)\citenamefont{Jorgensen,
16     Chandrasekhar, Madura, Impey, and Klein}}]{Jorgensen83}
17     \bibinfo{author}{\bibfnamefont{W.~L.} \bibnamefont{Jorgensen}},
18     \bibinfo{author}{\bibfnamefont{J.}~\bibnamefont{Chandrasekhar}},
19     \bibinfo{author}{\bibfnamefont{J.~D.} \bibnamefont{Madura}},
20     \bibinfo{author}{\bibfnamefont{R.~W.} \bibnamefont{Impey}}, \bibnamefont{and}
21     \bibinfo{author}{\bibfnamefont{M.~L.} \bibnamefont{Klein}},
22     \bibinfo{journal}{J. Chem. Phys.} \textbf{\bibinfo{volume}{79}},
23     \bibinfo{pages}{926} (\bibinfo{year}{1983}).
24    
25     \bibitem[{\citenamefont{Berendsen et~al.}(1987)\citenamefont{Berendsen,
26     Grigera, and Straatsma}}]{Berendsen87}
27     \bibinfo{author}{\bibfnamefont{H.~J.~C.} \bibnamefont{Berendsen}},
28     \bibinfo{author}{\bibfnamefont{J.~R.} \bibnamefont{Grigera}},
29     \bibnamefont{and} \bibinfo{author}{\bibfnamefont{T.~P.}
30     \bibnamefont{Straatsma}}, \bibinfo{journal}{J. Phys. Chem.}
31     \textbf{\bibinfo{volume}{91}}, \bibinfo{pages}{6269} (\bibinfo{year}{1987}).
32    
33     \bibitem[{\citenamefont{Mahoney and Jorgensen}(2000)}]{Jorgensen00}
34     \bibinfo{author}{\bibfnamefont{M.~W.} \bibnamefont{Mahoney}} \bibnamefont{and}
35     \bibinfo{author}{\bibfnamefont{W.~L.} \bibnamefont{Jorgensen}},
36     \bibinfo{journal}{J. Chem. Phys.}
37     \textbf{\bibinfo{volume}{112}}(\bibinfo{number}{20}), \bibinfo{pages}{8910}
38     (\bibinfo{year}{2000}).
39    
40     \bibitem[{\citenamefont{Mahoney and Jorgensen}(2001)}]{Jorgensen01}
41     \bibinfo{author}{\bibfnamefont{M.~W.} \bibnamefont{Mahoney}} \bibnamefont{and}
42     \bibinfo{author}{\bibfnamefont{W.~L.} \bibnamefont{Jorgensen}},
43     \bibinfo{journal}{J. Chem. Phys.}
44     \textbf{\bibinfo{volume}{114}}(\bibinfo{number}{1}), \bibinfo{pages}{363}
45     (\bibinfo{year}{2001}).
46    
47     \bibitem[{\citenamefont{Liu and Ichiye}(1996{\natexlab{a}})}]{Ichiye96}
48     \bibinfo{author}{\bibfnamefont{Y.}~\bibnamefont{Liu}} \bibnamefont{and}
49     \bibinfo{author}{\bibfnamefont{T.}~\bibnamefont{Ichiye}},
50     \bibinfo{journal}{J. Phys. Chem.} \textbf{\bibinfo{volume}{100}},
51     \bibinfo{pages}{2723} (\bibinfo{year}{1996}{\natexlab{a}}).
52    
53     \bibitem[{\citenamefont{Bratko et~al.}(1985)\citenamefont{Bratko, Blum, and
54     Luzar}}]{Bratko85}
55     \bibinfo{author}{\bibfnamefont{D.}~\bibnamefont{Bratko}},
56     \bibinfo{author}{\bibfnamefont{L.}~\bibnamefont{Blum}}, \bibnamefont{and}
57     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Luzar}}, \bibinfo{journal}{J.
58     Chem. Phys.} \textbf{\bibinfo{volume}{83}}(\bibinfo{number}{12}),
59     \bibinfo{pages}{6367} (\bibinfo{year}{1985}).
60    
61     \bibitem[{\citenamefont{Blum et~al.}(1995)\citenamefont{Blum, Vericat, and
62     Bratko}}]{Bratko95}
63     \bibinfo{author}{\bibfnamefont{L.}~\bibnamefont{Blum}},
64     \bibinfo{author}{\bibfnamefont{F.}~\bibnamefont{Vericat}}, \bibnamefont{and}
65     \bibinfo{author}{\bibfnamefont{D.}~\bibnamefont{Bratko}},
66     \bibinfo{journal}{J. Chem. Phys.}
67     \textbf{\bibinfo{volume}{102}}(\bibinfo{number}{3}), \bibinfo{pages}{1461}
68     (\bibinfo{year}{1995}).
69    
70     \bibitem[{\citenamefont{Chandra and Ichiye}(1999)}]{Ichiye99}
71     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Chandra}} \bibnamefont{and}
72     \bibinfo{author}{\bibfnamefont{T.}~\bibnamefont{Ichiye}},
73     \bibinfo{journal}{J. Chem. Phys.}
74     \textbf{\bibinfo{volume}{111}}(\bibinfo{number}{6}), \bibinfo{pages}{2701}
75     (\bibinfo{year}{1999}).
76    
77     \bibitem[{\citenamefont{Liu and Ichiye}(1996{\natexlab{b}})}]{Ichiye96b}
78     \bibinfo{author}{\bibfnamefont{Y.}~\bibnamefont{Liu}} \bibnamefont{and}
79     \bibinfo{author}{\bibfnamefont{T.}~\bibnamefont{Ichiye}},
80     \bibinfo{journal}{Chem. Phys. Lett.} \textbf{\bibinfo{volume}{256}},
81     \bibinfo{pages}{334} (\bibinfo{year}{1996}{\natexlab{b}}).
82    
83     \bibitem[{\citenamefont{Allen and Tildesley}(1987)}]{AllenTildesley}
84     \bibinfo{author}{\bibfnamefont{M.~P.} \bibnamefont{Allen}} \bibnamefont{and}
85     \bibinfo{author}{\bibfnamefont{D.~J.} \bibnamefont{Tildesley}},
86     \emph{\bibinfo{title}{Computer Simulation of Liquids}}
87     (\bibinfo{publisher}{Oxford University Press}, \bibinfo{address}{New York},
88     \bibinfo{year}{1987}).
89    
90     \bibitem[{\citenamefont{van~der Spoel et~al.}(1998)\citenamefont{van~der Spoel,
91     van Maaren, and Berendsen}}]{Berendsen98}
92     \bibinfo{author}{\bibfnamefont{D.}~\bibnamefont{van~der Spoel}},
93     \bibinfo{author}{\bibfnamefont{P.~J.} \bibnamefont{van Maaren}},
94     \bibnamefont{and} \bibinfo{author}{\bibfnamefont{H.~J.~C.}
95     \bibnamefont{Berendsen}}, \bibinfo{journal}{J. Chem. Phys.}
96     \textbf{\bibinfo{volume}{111}}(\bibinfo{number}{6}), \bibinfo{pages}{10220}
97     (\bibinfo{year}{1998}).
98    
99     \bibitem[{\citenamefont{Hoover}(1985)}]{Hoover85}
100     \bibinfo{author}{\bibfnamefont{W.~G.} \bibnamefont{Hoover}},
101     \bibinfo{journal}{Phys. Rev. A}
102     \textbf{\bibinfo{volume}{31}}(\bibinfo{number}{3}), \bibinfo{pages}{1695}
103     (\bibinfo{year}{1985}).
104    
105     \bibitem[{\citenamefont{Hoover}(1986)}]{Hoover86}
106     \bibinfo{author}{\bibfnamefont{W.~G.} \bibnamefont{Hoover}},
107     \bibinfo{journal}{Phys. Rev. A}
108     \textbf{\bibinfo{volume}{34}}(\bibinfo{number}{3}), \bibinfo{pages}{2499}
109     (\bibinfo{year}{1986}).
110    
111     \bibitem[{\citenamefont{Dullweber et~al.}(1997)\citenamefont{Dullweber,
112     Leimkuhler, and McLachlan}}]{Dullweber1997}
113     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Dullweber}},
114     \bibinfo{author}{\bibfnamefont{B.}~\bibnamefont{Leimkuhler}},
115     \bibnamefont{and}
116     \bibinfo{author}{\bibfnamefont{R.}~\bibnamefont{McLachlan}},
117     \bibinfo{journal}{J. Chem. Phys.}
118     \textbf{\bibinfo{volume}{107}}(\bibinfo{number}{15}), \bibinfo{pages}{5840}
119     (\bibinfo{year}{1997}).
120    
121     \bibitem[{\citenamefont{Kol et~al.}(1997)\citenamefont{Kol, Laird, and
122     Leimkuhler}}]{Laird97}
123     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Kol}},
124     \bibinfo{author}{\bibfnamefont{B.~B.} \bibnamefont{Laird}}, \bibnamefont{and}
125     \bibinfo{author}{\bibfnamefont{B.~J.} \bibnamefont{Leimkuhler}},
126     \bibinfo{journal}{J. Chem. Phys.}
127     \textbf{\bibinfo{volume}{107}}(\bibinfo{number}{7}), \bibinfo{pages}{2580}
128     (\bibinfo{year}{1997}).
129    
130     \bibitem[{\citenamefont{Bernal and Fowler}(1933)}]{Bernal33}
131     \bibinfo{author}{\bibfnamefont{J.~D.} \bibnamefont{Bernal}} \bibnamefont{and}
132     \bibinfo{author}{\bibfnamefont{R.~H.} \bibnamefont{Fowler}},
133     \bibinfo{journal}{J. Chem. Phys.} \textbf{\bibinfo{volume}{1}},
134     \bibinfo{pages}{515} (\bibinfo{year}{1933}).
135    
136     \bibitem[{\citenamefont{Rahman and Stillinger}(1972)}]{Rahman72}
137     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Rahman}} \bibnamefont{and}
138     \bibinfo{author}{\bibfnamefont{F.~H.} \bibnamefont{Stillinger}},
139     \bibinfo{journal}{J. Chem. Phys.}
140     \textbf{\bibinfo{volume}{57}}(\bibinfo{number}{9}), \bibinfo{pages}{4009}
141     (\bibinfo{year}{1972}).
142    
143     \bibitem[{\citenamefont{Jorgensen and Jenson}(1998)}]{Jorgensen98b}
144     \bibinfo{author}{\bibfnamefont{W.~L.} \bibnamefont{Jorgensen}}
145     \bibnamefont{and} \bibinfo{author}{\bibfnamefont{C.}~\bibnamefont{Jenson}},
146     \bibinfo{journal}{J. Comput. Chem.}
147     \textbf{\bibinfo{volume}{19}}(\bibinfo{number}{10}), \bibinfo{pages}{1179}
148     (\bibinfo{year}{1998}).
149    
150     \bibitem[{\citenamefont{B\'{a}ez and Clancy}(1994)}]{Clancy94}
151     \bibinfo{author}{\bibfnamefont{L.~A.} \bibnamefont{B\'{a}ez}} \bibnamefont{and}
152     \bibinfo{author}{\bibfnamefont{P.}~\bibnamefont{Clancy}},
153     \bibinfo{journal}{J. Chem. Phys.}
154     \textbf{\bibinfo{volume}{101}}(\bibinfo{number}{11}), \bibinfo{pages}{9837}
155     (\bibinfo{year}{1994}).
156    
157     \bibitem[{\citenamefont{Weast}(1980)}]{CRC80}
158     \bibinfo{editor}{\bibfnamefont{R.~C.} \bibnamefont{Weast}}, ed.,
159     \emph{\bibinfo{title}{CRC Handbook of Chemistry and Physics}}
160     (\bibinfo{publisher}{CRC Press, Inc.}, \bibinfo{address}{Boca Raton, FL},
161     \bibinfo{year}{1980}), \bibinfo{edition}{60th} ed.
162    
163     \bibitem[{\citenamefont{Gillen et~al.}(1972)\citenamefont{Gillen, Douglas, and
164     Hoch}}]{Gillen72}
165     \bibinfo{author}{\bibnamefont{Gillen}},
166     \bibinfo{author}{\bibnamefont{Douglas}}, \bibnamefont{and}
167     \bibinfo{author}{\bibnamefont{Hoch}}, \bibinfo{journal}{J. Chem. Phys.}
168     \textbf{\bibinfo{volume}{57}}, \bibinfo{pages}{5117} (\bibinfo{year}{1972}).
169    
170     \bibitem[{\citenamefont{Mills}(1973)}]{Mills73}
171     \bibinfo{author}{\bibfnamefont{R.}~\bibnamefont{Mills}}, \bibinfo{journal}{J.
172     Phys. Chem.} \textbf{\bibinfo{volume}{77}}(\bibinfo{number}{5}),
173     \bibinfo{pages}{685} (\bibinfo{year}{1973}).
174    
175     \bibitem[{\citenamefont{Hura et~al.}(2000)\citenamefont{Hura, Sorenson,
176     Glaeser, and Head-Gordon}}]{Head-Gordon00_1}
177     \bibinfo{author}{\bibfnamefont{G.}~\bibnamefont{Hura}},
178     \bibinfo{author}{\bibfnamefont{J.~M.} \bibnamefont{Sorenson}},
179     \bibinfo{author}{\bibfnamefont{R.~M.} \bibnamefont{Glaeser}},
180     \bibnamefont{and}
181     \bibinfo{author}{\bibfnamefont{T.}~\bibnamefont{Head-Gordon}},
182     \bibinfo{journal}{J. Chem. Phys.}
183     \textbf{\bibinfo{volume}{113}}(\bibinfo{number}{20}), \bibinfo{pages}{9140}
184     (\bibinfo{year}{2000}).
185    
186     \bibitem[{\citenamefont{Soper and Phillips}(1986)}]{Soper86}
187     \bibinfo{author}{\bibfnamefont{A.~K.} \bibnamefont{Soper}} \bibnamefont{and}
188     \bibinfo{author}{\bibfnamefont{M.~G.} \bibnamefont{Phillips}},
189     \bibinfo{journal}{Chem. Phys.}
190     \textbf{\bibinfo{volume}{107}}(\bibinfo{number}{1}), \bibinfo{pages}{47}
191     (\bibinfo{year}{1986}).
192    
193     \bibitem[{\citenamefont{Sprik}(1991)}]{Sprik91}
194     \bibinfo{author}{\bibfnamefont{M.}~\bibnamefont{Sprik}}, \bibinfo{journal}{J.
195     Chem. Phys.} \textbf{\bibinfo{volume}{95}}(\bibinfo{number}{9}),
196     \bibinfo{pages}{6762} (\bibinfo{year}{1991}).
197    
198     \bibitem[{\citenamefont{Gubskaya and Kusalik}(2002)}]{Kusalik02}
199     \bibinfo{author}{\bibfnamefont{A.~V.} \bibnamefont{Gubskaya}} \bibnamefont{and}
200     \bibinfo{author}{\bibfnamefont{P.~G.} \bibnamefont{Kusalik}},
201     \bibinfo{journal}{J. Chem. Phys.}
202     \textbf{\bibinfo{volume}{117}}(\bibinfo{number}{11}), \bibinfo{pages}{5290}
203     (\bibinfo{year}{2002}).
204    
205     \bibitem[{\citenamefont{Badyal et~al.}(2000)\citenamefont{Badyal, Saboungi,
206     Price, Shastri, Haeffner, and Soper}}]{Badyal00}
207     \bibinfo{author}{\bibfnamefont{Y.~S.} \bibnamefont{Badyal}},
208     \bibinfo{author}{\bibfnamefont{M.~L.} \bibnamefont{Saboungi}},
209     \bibinfo{author}{\bibfnamefont{D.~L.} \bibnamefont{Price}},
210     \bibinfo{author}{\bibfnamefont{S.~D.} \bibnamefont{Shastri}},
211     \bibinfo{author}{\bibfnamefont{D.~R.} \bibnamefont{Haeffner}},
212     \bibnamefont{and} \bibinfo{author}{\bibfnamefont{A.~K.} \bibnamefont{Soper}},
213     \bibinfo{journal}{J. Chem. Phys.}
214     \textbf{\bibinfo{volume}{112}}(\bibinfo{number}{21}), \bibinfo{pages}{9206}
215     (\bibinfo{year}{2000}).
216    
217     \bibitem[{\citenamefont{Barriol and Weisbecker}(1964)}]{Barriol64}
218     \bibinfo{author}{\bibfnamefont{J.}~\bibnamefont{Barriol}} \bibnamefont{and}
219     \bibinfo{author}{\bibfnamefont{A.}~\bibnamefont{Weisbecker}},
220     \bibinfo{journal}{Compt. Rend. Acad. Sc. Paris}
221     \textbf{\bibinfo{volume}{259}}, \bibinfo{pages}{4643} (\bibinfo{year}{1964}).
222    
223     \bibitem[{\citenamefont{Brooks et~al.}(1983)\citenamefont{Brooks, Bruccoleri,
224     Olafson, States, Swaminathan, and Karplus}}]{Karplus83}
225     \bibinfo{author}{\bibfnamefont{B.~R.} \bibnamefont{Brooks}},
226     \bibinfo{author}{\bibfnamefont{R.~E.} \bibnamefont{Bruccoleri}},
227     \bibinfo{author}{\bibfnamefont{B.~D.} \bibnamefont{Olafson}},
228     \bibinfo{author}{\bibfnamefont{D.~J.} \bibnamefont{States}},
229     \bibinfo{author}{\bibfnamefont{S.}~\bibnamefont{Swaminathan}},
230     \bibnamefont{and} \bibinfo{author}{\bibfnamefont{M.}~\bibnamefont{Karplus}},
231     \bibinfo{journal}{J. Comput. Chem.}
232     \textbf{\bibinfo{volume}{4}}(\bibinfo{number}{2}), \bibinfo{pages}{187}
233     (\bibinfo{year}{1983}).
234    
235     \end{thebibliography}