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%merlin.mbs aipnum4-1.bst 2010-07-25 4.21a (PWD, AO, DPC) hacked |
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\begin{thebibliography}{17}% |
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%</preamble> |
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\bibitem [{\citenamefont {Wolf}\ \emph {et~al.}(1999)\citenamefont {Wolf}, |
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\citenamefont {Keblinski}, \citenamefont {Phillpot},\ and\ \citenamefont |
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{Eggebrecht}}]{Wolf99}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {D.}~\bibnamefont |
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{Wolf}}, \bibinfo {author} {\bibfnamefont {P.}~\bibnamefont {Keblinski}}, |
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\bibinfo {author} {\bibfnamefont {S.~R.}\ \bibnamefont {Phillpot}}, \ and\ |
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\bibinfo {author} {\bibfnamefont {J.}~\bibnamefont {Eggebrecht}},\ |
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}\href@noop {} {\bibfield {journal} {\bibinfo {journal} {J. Chem. Phys.}\ |
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}\textbf {\bibinfo {volume} {110}},\ \bibinfo {pages} {8254} (\bibinfo {year} |
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{1999})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Zahn}, \citenamefont {Schilling},\ and\ \citenamefont |
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{Kast}(2002)}]{Zahn02}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {D.}~\bibnamefont |
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{Zahn}}, \bibinfo {author} {\bibfnamefont {B.}~\bibnamefont {Schilling}}, \ |
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and\ \bibinfo {author} {\bibfnamefont {S.~M.}\ \bibnamefont {Kast}},\ |
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}\href@noop {} {\bibfield {journal} {\bibinfo {journal} {J. Phys. Chem. B}\ |
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}\textbf {\bibinfo {volume} {106}},\ \bibinfo {pages} {10725} (\bibinfo |
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{year} {2002})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Kast}, \citenamefont {Schmidt},\ and\ \citenamefont |
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{Schilling}(2003)}]{Kast03}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {S.~M.}\ \bibnamefont |
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{Kast}}, \bibinfo {author} {\bibfnamefont {K.~F.}\ \bibnamefont {Schmidt}}, \ |
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and\ \bibinfo {author} {\bibfnamefont {B.}~\bibnamefont {Schilling}},\ |
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}\href@noop {} {\bibfield {journal} {\bibinfo {journal} {Chem. Phys. |
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Lett.}\ }\textbf {\bibinfo {volume} {367}},\ \bibinfo {pages} {398} (\bibinfo |
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{year} {2003})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Beck}, \citenamefont {Armen},\ and\ \citenamefont |
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{Daggett}(2005)}]{Beckd.A.C._Bi0486381}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {D.}~\bibnamefont |
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{Beck}}, \bibinfo {author} {\bibfnamefont {R.}~\bibnamefont {Armen}}, \ and\ |
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\bibinfo {author} {\bibfnamefont {V.}~\bibnamefont {Daggett}},\ }\href |
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{Http://Pubs3.Acs.Org/Acs/Journals/Doilookup?In_Doi=10.1021/Bi0486381} |
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{\bibfield {journal} {\bibinfo {journal} {Biochemistry}\ }\textbf {\bibinfo |
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{volume} {44}},\ \bibinfo {pages} {609} (\bibinfo {year} {2005})}\BibitemShut |
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{NoStop}% |
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\bibitem [{\citenamefont {Ma}\ and\ \citenamefont {Garofalini}(2005)}]{Ma05}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {Y.}~\bibnamefont |
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{Ma}}\ and\ \bibinfo {author} {\bibfnamefont {S.~H.}\ \bibnamefont |
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{Garofalini}},\ }\href@noop {} {\bibfield {journal} {\bibinfo {journal} |
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{Mol. Simul.}\ }\textbf {\bibinfo {volume} {31}},\ \bibinfo {pages} {739} |
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(\bibinfo {year} {2005})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Fennell}\ and\ \citenamefont |
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{Gezelter}(2006)}]{Fennell06}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {C.~J.}\ \bibnamefont |
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{Fennell}}\ and\ \bibinfo {author} {\bibfnamefont {J.~D.}\ \bibnamefont |
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{Gezelter}},\ }\href {\doibase 10.1063/1.2206581} {\bibfield {journal} |
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{\bibinfo {journal} {J. Chem. Phys.}\ }\textbf {\bibinfo {volume} {124}},\ |
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\bibinfo {pages} {234104(12)} (\bibinfo {year} {2006})}\BibitemShut {NoStop}% |
| 107 |
\bibitem [{\citenamefont {Allen}\ and\ \citenamefont |
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{Tildesley}(1989)}]{Allen:1989fp}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {M.~P.}\ \bibnamefont |
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{Allen}}\ and\ \bibinfo {author} {\bibfnamefont {D.~J.}\ \bibnamefont |
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{Tildesley}},\ }\href |
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{http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/0198556454} |
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{\emph {\bibinfo {title} {{Computer Simulation of Liquids}}}},\ \bibinfo |
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{edition} {reprint}\ ed.,\ Oxford science publications\ (\bibinfo |
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{publisher} {Oxford University Press, USA},\ \bibinfo {year} |
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{1989})\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Neumann}(1983)}]{Neumann:1983mz}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {M.}~\bibnamefont |
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{Neumann}},\ }\href {\doibase 10.1080/00268978300102721} {\bibfield |
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{journal} {\bibinfo {journal} {Molecular Physics}\ }\textbf {\bibinfo |
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{volume} {50}},\ \bibinfo {pages} {841} (\bibinfo {year} {1983})}\BibitemShut |
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{NoStop}% |
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\bibitem [{\citenamefont {Neumann}\ and\ \citenamefont |
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{Steinhauser}(1983)}]{Neumann:1983yq}% |
| 127 |
\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {M.}~\bibnamefont |
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{Neumann}}\ and\ \bibinfo {author} {\bibfnamefont {O.}~\bibnamefont |
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{Steinhauser}},\ }\href {\doibase |
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http://dx.doi.org/10.1016/0009-2614(83)80585-5} {\bibfield {journal} |
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{\bibinfo {journal} {Chemical Physics Letters}\ }\textbf {\bibinfo {volume} |
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{95}},\ \bibinfo {pages} {417 } (\bibinfo {year} {1983})}\BibitemShut |
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{NoStop}% |
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\bibitem [{\citenamefont {Neumann}, \citenamefont {Steinhauser},\ and\ |
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\citenamefont {Pawley}(1984)}]{Neumann84}% |
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\BibitemOpen |
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{Neumann}}, \bibinfo {author} {\bibfnamefont {O.}~\bibnamefont |
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{Steinhauser}}, \ and\ \bibinfo {author} {\bibfnamefont {G.~S.}\ \bibnamefont |
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{Pawley}},\ }\href@noop {} {\bibfield {journal} {\bibinfo {journal} {Mol. |
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Phys.}\ }\textbf {\bibinfo {volume} {52}},\ \bibinfo {pages} {97} (\bibinfo |
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{year} {1984})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Neumann}(1985)}]{Neumann85}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {M.}~\bibnamefont |
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{Neumann}},\ }\href@noop {} {\bibfield {journal} {\bibinfo {journal} {J. |
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Chem. Phys.}\ }\textbf {\bibinfo {volume} {82}},\ \bibinfo {pages} {5663} |
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(\bibinfo {year} {1985})}\BibitemShut {NoStop}% |
| 150 |
\bibitem [{\citenamefont {Horn}\ \emph {et~al.}(2004)\citenamefont {Horn}, |
| 151 |
\citenamefont {Swope}, \citenamefont {Pitera}, \citenamefont {Madura}, |
| 152 |
\citenamefont {Dick}, \citenamefont {Hura},\ and\ \citenamefont |
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{Head-Gordon}}]{Horn04}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {H.~W.}\ \bibnamefont |
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{Horn}}, \bibinfo {author} {\bibfnamefont {W.~C.}\ \bibnamefont {Swope}}, |
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\bibinfo {author} {\bibfnamefont {J.~W.}\ \bibnamefont {Pitera}}, \bibinfo |
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{author} {\bibfnamefont {J.~D.}\ \bibnamefont {Madura}}, \bibinfo {author} |
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{\bibfnamefont {T.~J.}\ \bibnamefont {Dick}}, \bibinfo {author} |
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{\bibfnamefont {G.~L.}\ \bibnamefont {Hura}}, \ and\ \bibinfo {author} |
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{\bibfnamefont {T.}~\bibnamefont {Head-Gordon}},\ }\href {\doibase |
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10.1063/1.1683075} {\bibfield {journal} {\bibinfo {journal} {J. Chem. |
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Phys.}\ }\textbf {\bibinfo {volume} {120}},\ \bibinfo {pages} {9665} |
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(\bibinfo {year} {2004})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Izvekov}, \citenamefont {Swanson},\ and\ |
| 166 |
\citenamefont {Voth}(2008)}]{Izvekov:2008wo}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {S.}~\bibnamefont |
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{Izvekov}}, \bibinfo {author} {\bibfnamefont {J.~M.~J.}\ \bibnamefont |
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{Swanson}}, \ and\ \bibinfo {author} {\bibfnamefont {G.~A.}\ \bibnamefont |
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{Voth}},\ }\href {\doibase DOI 10.1021/jp710339n} {\bibfield {journal} |
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{\bibinfo {journal} {J. Phys. Chem. B}\ }\textbf {\bibinfo {volume} {112}},\ |
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\bibinfo {pages} {4711} (\bibinfo {year} {2008})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Adams}(1980)}]{Adams:1980rt}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {D.}~\bibnamefont |
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{Adams}},\ }\href {\doibase 10.1080/00268978000102261} {\bibfield {journal} |
| 178 |
{\bibinfo {journal} {Molecular Physics}\ }\textbf {\bibinfo {volume} {40}},\ |
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\bibinfo {pages} {1261} (\bibinfo {year} {1980})}\BibitemShut {NoStop}% |
| 180 |
\bibitem [{\citenamefont {Adams}\ and\ \citenamefont |
| 181 |
{Adams}(1981)}]{Adams:1981fr}% |
| 182 |
\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {D.}~\bibnamefont |
| 184 |
{Adams}}\ and\ \bibinfo {author} {\bibfnamefont {E.}~\bibnamefont {Adams}},\ |
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| 186 |
{journal} {Molecular Physics}\ }\textbf {\bibinfo {volume} {42}},\ \bibinfo |
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{pages} {907} (\bibinfo {year} {1981})}\BibitemShut {NoStop}% |
| 188 |
\bibitem [{\citenamefont {Torres~del Castillo}\ and\ \citenamefont |
| 189 |
{M\'{e}ndez~Garrido}(2006)}]{Torres-del-Castillo:2006uo}% |
| 190 |
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| 191 |
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{Torres~del Castillo}}\ and\ \bibinfo {author} {\bibfnamefont |
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{A.}~\bibnamefont {M\'{e}ndez~Garrido}},\ }\href@noop {} {\bibfield |
| 194 |
{journal} {\bibinfo {journal} {Revista Mexicana de F\'{i}sica}\ }\textbf |
| 195 |
{\bibinfo {volume} {52}},\ \bibinfo {pages} {501} (\bibinfo {year} |
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{2006})}\BibitemShut {NoStop}% |
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\bibitem [{\citenamefont {Smith}(1998)}]{Smith98}% |
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\BibitemOpen |
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\bibfield {author} {\bibinfo {author} {\bibfnamefont {W.}~\bibnamefont |
| 200 |
{Smith}},\ }\href@noop {} {\bibfield {journal} {\bibinfo {journal} {CCP5 |
| 201 |
Information Quarterly}\ }\textbf {\bibinfo {volume} {46}},\ \bibinfo {pages} |
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{18} (\bibinfo {year} {1998})}\BibitemShut {NoStop}% |
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\end{thebibliography}% |