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Revision 3811 by jmichalk, Thu Dec 13 22:42:37 2012 UTC vs.
Revision 3862 by jmichalk, Fri Feb 22 18:33:25 2013 UTC

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4  
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71   @string{rmp = {Rev. Mod. Phys.}}
72  
73   @string{ss = {Surf. Sci.}}
74 +
75 +
76 + @article{Williams:1994,
77 +        Author = {Ellen D. Williams},
78 +        Date-Added = {2013-02-20 19:36:23 +0000},
79 +        Date-Modified = {2013-02-20 19:38:05 +0000},
80 +        Journal = {Surface Science},
81 +        Pages = {502-524},
82 +        Rating = {5},
83 +        Title = {Surface steps and surface morphology: understanding macroscopic phenomena from atomic observations},
84 +        Volume = {299/300},
85 +        Year = {1994}}
86 +
87 + @article{Williams:1991,
88 +        Author = {Ellen D. Williams and N. C. Bartelt},
89 +        Date-Added = {2013-02-20 18:53:30 +0000},
90 +        Date-Modified = {2013-02-20 18:55:16 +0000},
91 +        Journal = {Science},
92 +        Keywords = {steps},
93 +        Month = {January},
94 +        Pages = {393-400},
95 +        Title = {Thermodynamics of Surface Morphology},
96 +        Volume = {251},
97 +        Year = {1991}}
98 +
99 + @article{Pearl,
100 +        Author = {T. P. Pearl and S. J. Sibener},
101 +        Date-Added = {2013-01-21 21:18:40 +0000},
102 +        Date-Modified = {2013-01-21 21:20:29 +0000},
103 +        Journal = {J. Chem. Phys.},
104 +        Keywords = {Zipper},
105 +        Month = {July},
106 +        Number = {4},
107 +        Pages = {1916},
108 +        Title = {Oxygen driven reconstruction dynamics of Ni(977) measured by time-lapse scanning tunneling microscopy},
109 +        Volume = {115},
110 +        Year = {2001}}
111 +
112 + @article{McCarthy:2012,
113 +        Author = {D. N. McCarthy and C. E. Strebel and T. P. Johansson and A. den Dunnen and A. Nierhoff and J. H. Nielsen and Ib Chorkendorff},
114 +        Date-Added = {2013-01-09 20:03:45 +0000},
115 +        Date-Modified = {2013-01-09 20:06:33 +0000},
116 +        Journal = {J. Phys. Chem. C},
117 +        Keywords = {Mobility},
118 +        Month = {June},
119 +        Pages = {15353},
120 +        Title = {Structural Modification of Platinum Model Systems under High Pressure CO Annealing},
121 +        Volume = {116},
122 +        Year = {2012}}
123 +
124 + @article{PhysRevB.13.5188,
125 +        Author = {Monkhorst, Hendrik J. and Pack, James D.},
126 +        Date-Added = {2012-12-14 16:27:06 +0000},
127 +        Date-Modified = {2012-12-14 16:27:06 +0000},
128 +        Doi = {10.1103/PhysRevB.13.5188},
129 +        Journal = prb,
130 +        Month = {Jun},
131 +        Number = {12},
132 +        Numpages = {4},
133 +        Pages = {5188--5192},
134 +        Publisher = {American Physical Society},
135 +        Title = {Special points for Brillouin-zone integrations},
136 +        Volume = {13},
137 +        Year = {1976},
138 +        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.13.5188}}
139 +
140 + @article{PhysRevB.59.1758,
141 +        Author = {Kresse, G. and Joubert, D.},
142 +        Date-Added = {2012-12-14 16:26:58 +0000},
143 +        Date-Modified = {2012-12-14 16:26:58 +0000},
144 +        Doi = {10.1103/PhysRevB.59.1758},
145 +        Journal = prb,
146 +        Month = {Jan},
147 +        Number = {3},
148 +        Numpages = {17},
149 +        Pages = {1758--1775},
150 +        Publisher = {American Physical Society},
151 +        Title = {From ultrasoft pseudopotentials to the projector augmented-wave method},
152 +        Volume = {59},
153 +        Year = {1999},
154 +        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.59.1758}}
155 +
156 + @article{PhysRevB.50.17953,
157 +        Author = {Bl\"ochl, P. E.},
158 +        Date-Added = {2012-12-14 16:26:51 +0000},
159 +        Date-Modified = {2012-12-14 16:26:51 +0000},
160 +        Doi = {10.1103/PhysRevB.50.17953},
161 +        Journal = prb,
162 +        Month = {Dec},
163 +        Number = {24},
164 +        Numpages = {26},
165 +        Pages = {17953--17979},
166 +        Publisher = {American Physical Society},
167 +        Title = {Projector augmented-wave method},
168 +        Volume = {50},
169 +        Year = {1994},
170 +        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.50.17953}}
171 +
172 + @article{Tao2008,
173 +        Author = {F. Tao and M.~E. Grass and Y. Zhang and D.~R. Butcher and J.~R. Renzas and Z. Liu and J.~Y. Chung and B. S. Mun and M. Salmeron and G.~A. Somorjai},
174 +        Date-Added = {2012-12-15 22:06:57 +0000},
175 +        Date-Modified = {2012-12-15 22:12:10 +0000},
176 +        Journal = {Science},
177 +        Month = {November},
178 +        Pages = {932},
179 +        Title = {Reaction-Driven Restructuring of Rh-Pd and Pt-Pd Core-Shell Nanoparticles},
180 +        Volume = {322},
181 +        Year = {2008}}
182 +
183 + @article{Tao2011,
184 +        Author = {F. Tao and M. Salmeron},
185 +        Date-Added = {2012-12-15 22:05:07 +0000},
186 +        Date-Modified = {2012-12-15 22:06:26 +0000},
187 +        Journal = {Science},
188 +        Month = {Jan},
189 +        Pages = {171},
190 +        Title = {In Situ Studies of Chemistry and Structure of Materials in Reactive Environments},
191 +        Volume = {331},
192 +        Year = {2011}}
193 +
194 + @article{TPD_Gold,
195 +        Author = {G. S. Elliot and D. R. Miller},
196 +        Date-Added = {2012-12-14 21:32:06 +0000},
197 +        Date-Modified = {2012-12-14 21:33:43 +0000},
198 +        Journal = {Proc. 14th Int. Symp. on Rarefied Gas Dynamics},
199 +        Pages = {349-58},
200 +        Year = {1984}}
201 +
202 + @article{Ewald,
203 +        Author = {C. J. Fennell and J. D. Gezelter},
204 +        Date-Added = {2012-12-14 04:22:33 +0000},
205 +        Date-Modified = {2012-12-14 04:23:31 +0000},
206 +        Journal = {J. Chem. Phys.},
207 +        Keywords = {Ewald and OpenMD},
208 +        Month = {June},
209 +        Pages = {234104},
210 +        Title = {Is the Ewald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics},
211 +        Volume = {124},
212 +        Year = {2006}}
213 +
214 + @article{OOPSE,
215 +        Author = {Meineke, Matthew A. and Vardeman, Charles F. and Lin, Teng and Fennell, Christopher J. and Gezelter, J. Daniel},
216 +        Date-Added = {2012-12-14 04:19:33 +0000},
217 +        Date-Modified = {2012-12-14 04:19:40 +0000},
218 +        Doi = {10.1002/jcc.20161},
219 +        Issn = {1096-987X},
220 +        Journal = {Journal of Computational Chemistry},
221 +        Keywords = {OOPSE, molecular dynamics},
222 +        Number = {3},
223 +        Pages = {252--271},
224 +        Publisher = {Wiley Subscription Services, Inc., A Wiley Company},
225 +        Title = {OOPSE: An object-oriented parallel simulation engine for molecular dynamics},
226 +        Url = {http://dx.doi.org/10.1002/jcc.20161},
227 +        Volume = {26},
228 +        Year = {2005},
229 +        Bdsk-Url-1 = {http://dx.doi.org/10.1002/jcc.20161}}
230 +
231 + @article{Monkhorst:1976,
232 +        Author = {Monkhorst, Hendrik J. and Pack, James D.},
233 +        Date-Added = {2012-12-14 02:25:00 +0000},
234 +        Date-Modified = {2012-12-14 02:25:11 +0000},
235 +        Doi = {10.1103/PhysRevB.13.5188},
236 +        Issue = {12},
237 +        Journal = {Phys. Rev. B},
238 +        Month = {Jun},
239 +        Pages = {5188--5192},
240 +        Publisher = {American Physical Society},
241 +        Title = {Special points for Brillouin-zone integrations},
242 +        Url = {http://link.aps.org/doi/10.1103/PhysRevB.13.5188},
243 +        Volume = {13},
244 +        Year = {1976},
245 +        Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.13.5188},
246 +        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.13.5188}}
247 +
248 + @article{Perdew_GGA,
249 +        Author = {Perdew, John P. and Burke, Kieron and Ernzerhof, Matthias},
250 +        Date-Added = {2012-12-14 01:59:04 +0000},
251 +        Date-Modified = {2012-12-14 01:59:12 +0000},
252 +        Doi = {10.1103/PhysRevLett.77.3865},
253 +        Issue = {18},
254 +        Journal = {Phys. Rev. Lett.},
255 +        Month = {Oct},
256 +        Pages = {3865--3868},
257 +        Publisher = {American Physical Society},
258 +        Title = {Generalized Gradient Approximation Made Simple},
259 +        Url = {http://link.aps.org/doi/10.1103/PhysRevLett.77.3865},
260 +        Volume = {77},
261 +        Year = {1996},
262 +        Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.77.3865},
263 +        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.77.3865}}
264 +
265 + @article{RRKJ_PP,
266 +        Author = {Rappe, Andrew M. and Rabe, Karin M. and Kaxiras, Efthimios and Joannopoulos, J. D.},
267 +        Date-Added = {2012-12-14 01:39:59 +0000},
268 +        Date-Modified = {2012-12-14 01:40:21 +0000},
269 +        Doi = {10.1103/PhysRevB.41.1227},
270 +        Issue = {2},
271 +        Journal = {Phys. Rev. B},
272 +        Month = {Jan},
273 +        Pages = {1227--1230},
274 +        Publisher = {American Physical Society},
275 +        Title = {Optimized pseudopotentials},
276 +        Url = {http://link.aps.org/doi/10.1103/PhysRevB.41.1227},
277 +        Volume = {41},
278 +        Year = {1990},
279 +        Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.41.1227},
280 +        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.41.1227}}
281  
282 + @article{QE-2009,
283 +        Author = {Paolo Giannozzi and Stefano Baroni and Nicola Bonini and Matteo Calandra and Roberto Car and Carlo Cavazzoni and Davide Ceresoli and Guido L Chiarotti and Matteo Cococcioni and Ismaila Dabo and Andrea {Dal Corso} and Stefano de Gironcoli and Stefano Fabris and Guido Fratesi and Ralph Gebauer and Uwe Gerstmann and Christos Gougoussis and Anton Kokalj and Michele Lazzeri and Layla Martin-Samos and Nicola Marzari and Francesco Mauri and Riccardo Mazzarello and Stefano Paolini and Alfredo Pasquarello and Lorenzo Paulatto and Carlo Sbraccia and Sandro Scandolo and Gabriele Sclauzero and Ari P Seitsonen and Alexander Smogunov and Paolo Umari and Renata M Wentzcovitch},
284 +        Date-Added = {2012-12-14 01:34:50 +0000},
285 +        Date-Modified = {2012-12-14 01:34:50 +0000},
286 +        Journal = {Journal of Physics: Condensed Matter},
287 +        Number = {39},
288 +        Pages = {395502 (19pp)},
289 +        Title = {QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials},
290 +        Url = {http://www.quantum-espresso.org},
291 +        Volume = {21},
292 +        Year = {2009},
293 +        Bdsk-Url-1 = {http://www.quantum-espresso.org}}
294  
295   @article{Deshlahra:2012,
296          Author = {P. Deshlahra and J. Conway and E. E. Wolf and W. F. Schneider},
# Line 993 | Line 1212 | and suggest a reaction mechanism which is not observed
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1213          Z9 = {3909},
1214          Zb = {17},
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1216          Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.49.14251}}
1217  
1218   @article{doi:10.1126/science.1182122,

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