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1 gezelter 4007 %% This BibTeX bibliography file was created using BibDesk.
2     %% http://bibdesk.sourceforge.net/
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5 gezelter 4112 %% Created for Dan Gezelter at 2014-05-09 11:52:57 -0400
6 gezelter 4007
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11    
12 gezelter 4112 @article{Ha:2009xy,
13     Author = {Ha, Jeong-Hyon and Lee, Kyung-Koo and Park, Kwang-Hee and Choi, Jun-Ho and Jeon, Seung-Joon and Cho, Minhaeng},
14     Date-Added = {2014-05-09 14:55:45 +0000},
15     Date-Modified = {2014-05-09 15:51:10 +0000},
16     Doi = {http://dx.doi.org/10.1063/1.3140402},
17     Eid = 204509,
18     Journal = {J. Chem. Phys.},
19     Number = {20},
20     Pages = {204509},
21     Title = {Integrated and dispersed photon echo studies of nitrile stretching vibration of 4-cyanophenol in methanol},
22     Url = {http://scitation.aip.org/content/aip/journal/jcp/130/20/10.1063/1.3140402},
23     Volume = {130},
24     Year = {2009},
25     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/130/20/10.1063/1.3140402},
26     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.3140402}}
27    
28     @article{Ghosh:2009qf,
29     Author = {Ayanjeet Ghosh and Amanda Remorino and Matthew J. Tucker and Robin M. Hochstrasser},
30     Date-Added = {2014-05-09 14:54:37 +0000},
31     Date-Modified = {2014-05-09 15:51:20 +0000},
32     Doi = {http://dx.doi.org/10.1016/j.cplett.2008.12.094},
33     Issn = {0009-2614},
34     Journal = {Chem. Phys. Lett.},
35     Number = {4--6},
36     Pages = {325 - 330},
37     Title = {2D {IR} photon echo spectroscopy reveals hydrogen bond dynamics of aromatic nitriles},
38     Url = {http://www.sciencedirect.com/science/article/pii/S0009261408017521},
39     Volume = {469},
40     Year = {2009},
41     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/S0009261408017521},
42     Bdsk-Url-2 = {http://dx.doi.org/10.1016/j.cplett.2008.12.094}}
43    
44 jmarr 4056 @article{C3AN01651J,
45     Abstract = {In recent years{,} major developments in scanning electrochemical microscopy (SECM) have significantly broadened the application range of this electroanalytical technique from high-resolution electrochemical imaging via nanoscale probes to large scale mapping using arrays of microelectrodes. A major driving force in advancing the SECM methodology is based on developing more sophisticated probes beyond conventional micro-disc electrodes usually based on noble metals or carbon microwires. This critical review focuses on the design and development of advanced electrochemical probes particularly enabling combinations of SECM with other analytical measurement techniques to provide information beyond exclusively measuring electrochemical sample properties. Consequently{,} this critical review will focus on recent progress and new developments towards multifunctional imaging.},
46     Author = {Kranz, Christine},
47     Date-Added = {2014-02-27 19:40:33 +0000},
48     Date-Modified = {2014-02-27 19:40:33 +0000},
49     Doi = {10.1039/C3AN01651J},
50     Issue = {2},
51     Journal = {Analyst},
52     Pages = {336-352},
53     Publisher = {The Royal Society of Chemistry},
54     Title = {Recent advancements in nanoelectrodes and nanopipettes used in combined scanning electrochemical microscopy techniques},
55     Url = {http://dx.doi.org/10.1039/C3AN01651J},
56     Volume = {139},
57     Year = {2014},
58     Bdsk-Url-1 = {http://dx.doi.org/10.1039/C3AN01651J}}
59    
60 jmarr 4055 @article{Kojima19881789,
61     Author = {Hiroyuki Kojima and Yasushi Takagi and Hiroki Teramoto},
62     Date-Added = {2014-02-27 19:25:16 +0000},
63     Date-Modified = {2014-02-27 19:25:16 +0000},
64     Doi = {http://dx.doi.org/10.1016/0013-4686(88)85016-3},
65     Issn = {0013-4686},
66     Journal = {Electrochimica Acta},
67     Number = {12},
68     Pages = {1789 - 1793},
69     Title = {Electrochemiluminescence in liquid crystals},
70     Url = {http://www.sciencedirect.com/science/article/pii/0013468688850163},
71     Volume = {33},
72     Year = {1988},
73     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/0013468688850163},
74     Bdsk-Url-2 = {http://dx.doi.org/10.1016/0013-4686(88)85016-3}}
75    
76 gezelter 4042 @article{Berne:1972pb,
77     Author = {Berne, Bruce J. and Pechukas, Philip},
78     Date-Added = {2014-02-21 18:28:49 +0000},
79     Date-Modified = {2014-02-21 18:28:49 +0000},
80     Doi = {http://dx.doi.org/10.1063/1.1677837},
81 gezelter 4097 Journal = {J. Chem. Phys.},
82 gezelter 4042 Number = {8},
83     Pages = {4213-4216},
84     Title = {Gaussian Model Potentials for Molecular Interactions},
85     Url = {http://scitation.aip.org/content/aip/journal/jcp/56/8/10.1063/1.1677837},
86     Volume = {56},
87     Year = {1972},
88     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/56/8/10.1063/1.1677837},
89     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1677837}}
90    
91     @article{Luckhurst:1990fy,
92     Author = {Luckhurst, G. R. and Stephens, R. A. and Phippen, R. W.},
93     Date-Added = {2014-02-21 18:27:10 +0000},
94     Date-Modified = {2014-02-21 18:27:10 +0000},
95     Doi = {10.1080/02678299008047361},
96     Eprint = {http://www.tandfonline.com/doi/pdf/10.1080/02678299008047361},
97     Journal = {Liquid Crystals},
98     Number = {4},
99     Pages = {451-464},
100     Title = {Computer simulation studies of anisotropic systems. XIX. Mesophases formed by the Gay-Berne model mesogen},
101     Url = {http://www.tandfonline.com/doi/abs/10.1080/02678299008047361},
102     Volume = {8},
103     Year = {1990},
104     Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/02678299008047361},
105     Bdsk-Url-2 = {http://dx.doi.org/10.1080/02678299008047361}}
106    
107     @article{Auer:2007dp,
108     Abstract = {We present improvements on our previous approaches for calculating vibrational spectroscopy observables for the OH stretch region of dilute HOD in liquid D2O. These revised approaches are implemented to calculate IR and isotropic Raman spectra, using the SPC/E simulation model, and the results are in good agreement with experiment. We also calculate observables associated with three-pulse IR echoes: the peak shift and 2D-IR spectrum. The agreement with experiment for the former is improved over our previous calculations, but discrepancies between theory and experiment still exist. Using our proposed definition for hydrogen bonding in liquid water, we decompose the distribution of frequencies in the OH stretch region in terms of subensembles of HOD molecules with different local hydrogen-bonding environments. Such a decomposition allows us to make the connection with experiments and calculations on water clusters and more generally to understand the extent of the relationship between transition frequency and local structure in the liquid.},
109     Author = {Auer, B. and Kumar, R. and Schmidt, J. R. and Skinner, J. L.},
110     Date-Added = {2014-02-21 18:20:31 +0000},
111     Date-Modified = {2014-02-21 18:31:54 +0000},
112     Doi = {10.1073/pnas.0701482104},
113     Eprint = {http://www.pnas.org/content/104/36/14215.full.pdf+html},
114 gezelter 4097 Journal = {Proc. Natl. Acad. Sci. USA},
115 gezelter 4042 Number = {36},
116     Pages = {14215-14220},
117     Title = {Hydrogen bonding and Raman, IR, and 2D-IR spectroscopy of dilute \ce{HOD} in liquid \ce{D2O}},
118     Url = {http://www.pnas.org/content/104/36/14215.abstract},
119     Volume = {104},
120     Year = {2007},
121     Bdsk-Url-1 = {http://www.pnas.org/content/104/36/14215.abstract},
122     Bdsk-Url-2 = {http://dx.doi.org/10.1073/pnas.0701482104}}
123    
124     @article{Corcelli:2004ai,
125     Author = {Corcelli, S. A. and Lawrence, C. P. and Skinner, J. L.},
126     Date-Added = {2014-02-21 18:18:50 +0000},
127     Date-Modified = {2014-02-21 18:32:22 +0000},
128     Doi = {http://dx.doi.org/10.1063/1.1683072},
129 gezelter 4097 Journal = {J. Chem. Phys.},
130 gezelter 4042 Number = {17},
131     Pages = {8107-8117},
132     Title = {Combined electronic structure/molecular dynamics approach for ultrafast infrared spectroscopy of dilute \ce{HOD} in liquid \ce{H2O} and \ce{D2O}},
133     Url = {http://scitation.aip.org/content/aip/journal/jcp/120/17/10.1063/1.1683072},
134     Volume = {120},
135     Year = {2004},
136     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/120/17/10.1063/1.1683072},
137     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1683072}}
138    
139     @article{Morales:2009fp,
140     Author = {Morales, Christine M. and Thompson, Ward H.},
141     Date-Added = {2014-02-21 17:59:53 +0000},
142 gezelter 4097 Date-Modified = {2014-04-01 19:42:20 +0000},
143 gezelter 4042 Doi = {10.1021/jp8072969},
144     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp8072969},
145 gezelter 4097 Journal = {J. Phys. Chem. A},
146 gezelter 4042 Number = {10},
147     Pages = {1922-1933},
148     Title = {Simulations of Infrared Spectra of Nanoconfined Liquids: Acetonitrile Confined in Nanoscale, Hydrophilic Silica Pores},
149     Url = {http://pubs.acs.org/doi/abs/10.1021/jp8072969},
150     Volume = {113},
151     Year = {2009},
152     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp8072969},
153     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp8072969}}
154    
155 gezelter 4040 @article{Bose:2012eu,
156     Author = {Bose, Tushar Kanti and Saha, Jayashree},
157     Date-Added = {2014-02-21 14:00:07 +0000},
158     Date-Modified = {2014-02-21 14:00:07 +0000},
159     Doi = {10.1103/PhysRevE.86.050701},
160     Issue = {5},
161     Journal = {Phys. Rev. E},
162     Month = {Nov},
163     Numpages = {4},
164     Pages = {050701},
165     Publisher = {American Physical Society},
166     Title = {Origin of tilted-phase generation in systems of ellipsoidal molecules with dipolar interactions},
167     Url = {http://link.aps.org/doi/10.1103/PhysRevE.86.050701},
168     Volume = {86},
169     Year = {2012},
170     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.86.050701},
171     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.86.050701}}
172    
173 gezelter 4036 @article{FILLER:1964yg,
174     Abstract = {An interpolation formula is derived which gives an apodized spectrum as the convolution of the unapodized spectrum (sampled at suitable points) with the apodized apparatus function. This allows many apodizations to be applied to a single interferogram with the performance of only a single Fourier transformation. A further saving in computation effort is possible if the apodized apparatus function decays rapidly away from its center. Examples of such cases are presented, where the interferogram is weighted by a function which is a cosine series of only a few terms.},
175 gezelter 4042 Author = {A. S. Filler},
176 gezelter 4036 Date-Added = {2014-02-20 18:13:39 +0000},
177 gezelter 4042 Date-Modified = {2014-02-21 18:31:22 +0000},
178 gezelter 4036 Doi = {10.1364/JOSA.54.000762},
179     Journal = {J. Opt. Soc. Am.},
180     Month = {Jun},
181     Number = {6},
182     Pages = {762--764},
183     Publisher = {OSA},
184     Title = {Apodization and Interpolation in Fourier-Transform Spectroscopy},
185     Url = {http://www.opticsinfobase.org/abstract.cfm?URI=josa-54-6-762},
186     Volume = {54},
187     Year = {1964},
188     Bdsk-Url-1 = {http://www.opticsinfobase.org/abstract.cfm?URI=josa-54-6-762},
189     Bdsk-Url-2 = {http://dx.doi.org/10.1364/JOSA.54.000762}}
190    
191     @article{Naylor:2007rm,
192     Abstract = {Apodizing functions are used in Fourier transform spectroscopy (FTS) to reduce the magnitude of the sidelobes in the instrumental line shape (ILS), which are a direct result of the finite maximum optical path difference in the measured interferogram. Three apodizing functions, which are considered optimal in the sense of producing the smallest loss in spectral resolution for a given reduction in the magnitude of the largest sidelobe, find frequent use in FTS \[J. Opt. Soc. Am.66, 259 (1976)\]. We extend this series to include optimal apodizing functions corresponding to increases in the width of the ILS ranging from factors of 1.1 to 2.0 compared with its unapodized value, and we compare the results with other commonly used apodizing functions.},
193     Author = {David A. Naylor and Margaret K. Tahic},
194     Date-Added = {2014-02-20 16:45:24 +0000},
195     Date-Modified = {2014-02-20 16:45:24 +0000},
196     Doi = {10.1364/JOSAA.24.003644},
197     Journal = {J. Opt. Soc. Am. A},
198     Keywords = {Linewidth; Spectroscopy, Fourier transforms},
199     Month = {Nov},
200     Number = {11},
201     Pages = {3644--3648},
202     Publisher = {OSA},
203     Title = {Apodizing functions for Fourier transform spectroscopy},
204     Url = {http://josaa.osa.org/abstract.cfm?URI=josaa-24-11-3644},
205     Volume = {24},
206     Year = {2007},
207     Bdsk-Url-1 = {http://josaa.osa.org/abstract.cfm?URI=josaa-24-11-3644},
208     Bdsk-Url-2 = {http://dx.doi.org/10.1364/JOSAA.24.003644}}
209    
210 gezelter 4035 @article{Morse:1929xy,
211     Author = {Morse, Philip M.},
212     Date-Added = {2014-02-19 21:18:41 +0000},
213     Date-Modified = {2014-02-19 21:18:43 +0000},
214     Doi = {10.1103/PhysRev.34.57},
215     Issue = {1},
216     Journal = {Phys. Rev.},
217     Month = {Jul},
218     Numpages = {0},
219     Pages = {57--64},
220     Publisher = {American Physical Society},
221     Title = {Diatomic Molecules According to the Wave Mechanics. II. Vibrational Levels},
222     Url = {http://link.aps.org/doi/10.1103/PhysRev.34.57},
223     Volume = {34},
224     Year = {1929},
225     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRev.34.57},
226     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRev.34.57}}
227    
228     @article{Lee:1988qf,
229     Author = {Lee, Chengteh and Yang, Weitao and Parr, Robert G.},
230     Date-Added = {2014-02-19 21:03:16 +0000},
231     Date-Modified = {2014-02-19 21:03:19 +0000},
232     Doi = {10.1103/PhysRevB.37.785},
233     Issue = {2},
234     Journal = {Phys. Rev. B},
235     Month = {Jan},
236     Numpages = {0},
237     Pages = {785--789},
238     Publisher = {American Physical Society},
239     Title = {Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density},
240     Url = {http://link.aps.org/doi/10.1103/PhysRevB.37.785},
241     Volume = {37},
242     Year = {1988},
243     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.37.785},
244     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.37.785}}
245    
246     @article{Becke:1993kq,
247     Author = {Becke, Axel D.},
248     Date-Added = {2014-02-19 21:02:30 +0000},
249 gezelter 4042 Date-Modified = {2014-02-21 18:30:55 +0000},
250 gezelter 4035 Doi = {http://dx.doi.org/10.1063/1.464913},
251 gezelter 4097 Journal = {J. Chem. Phys.},
252 gezelter 4035 Number = {7},
253     Pages = {5648-5652},
254 gezelter 4042 Title = {Density-functional thermochemistry. III. The role of exact exchange},
255 gezelter 4035 Url = {http://scitation.aip.org/content/aip/journal/jcp/98/7/10.1063/1.464913},
256     Volume = {98},
257     Year = {1993},
258     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/98/7/10.1063/1.464913},
259     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.464913}}
260    
261 gezelter 4028 @book{Collings:1997rz,
262     Author = {Collings, P.J. and Hird, M.},
263     Date-Added = {2014-02-18 21:05:20 +0000},
264     Date-Modified = {2014-02-18 21:05:20 +0000},
265     Isbn = {9780203211199},
266     Publisher = {Taylor \& Francis},
267     Series = {Liquid Crystals Book Series},
268     Title = {Introduction to Liquid Crystals: Chemistry and Physics},
269     Url = {http://books.google.com/books?id=GBeDkKpZ5VQC},
270     Year = {1997},
271     Bdsk-Url-1 = {http://books.google.com/books?id=GBeDkKpZ5VQC}}
272    
273     @article{Cleaver:1996rt,
274     Author = {Cleaver, Douglas J. and Care, Christopher M. and Allen, Michael P. and Neal, Maureen P.},
275     Date-Added = {2014-02-18 21:01:40 +0000},
276     Date-Modified = {2014-02-18 21:01:42 +0000},
277     Doi = {10.1103/PhysRevE.54.559},
278     Issue = {1},
279     Journal = {Phys. Rev. E},
280     Month = {Jul},
281     Numpages = {0},
282     Pages = {559--567},
283     Publisher = {American Physical Society},
284     Title = {Extension and generalization of the Gay-Berne potential},
285     Url = {http://link.aps.org/doi/10.1103/PhysRevE.54.559},
286     Volume = {54},
287     Year = {1996},
288     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.54.559},
289     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.54.559}}
290    
291     @article{Kushick:1976xy,
292     Author = {Kushick, J. and Berne, Bruce J.},
293     Date-Added = {2014-02-18 21:00:21 +0000},
294     Date-Modified = {2014-02-18 21:00:21 +0000},
295     Doi = {http://dx.doi.org/10.1063/1.432403},
296 gezelter 4097 Journal = {J. Chem. Phys.},
297 gezelter 4028 Number = {4},
298     Pages = {1362-1367},
299     Title = {Computer simulation of anisotropic molecular fluids},
300     Url = {http://scitation.aip.org/content/aip/journal/jcp/64/4/10.1063/1.432403},
301     Volume = {64},
302     Year = {1976},
303     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/64/4/10.1063/1.432403},
304     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.432403}}
305    
306     @article{Gay:1981yu,
307     Author = {Gay, J. G. and Berne, B. J.},
308     Date-Added = {2014-02-18 20:57:16 +0000},
309     Date-Modified = {2014-02-18 20:57:16 +0000},
310     Doi = {http://dx.doi.org/10.1063/1.441483},
311 gezelter 4097 Journal = {J. Chem. Phys.},
312 gezelter 4028 Number = {6},
313     Pages = {3316-3319},
314     Title = {Modification of the overlap potential to mimic a linear site--site potential},
315     Url = {http://scitation.aip.org/content/aip/journal/jcp/74/6/10.1063/1.441483},
316     Volume = {74},
317     Year = {1981},
318     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/74/6/10.1063/1.441483},
319     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.441483}}
320    
321     @article{Choi:2008cr,
322     Author = {Choi, Jun-Ho and Oh, Kwang-Im and Lee, Hochan and Lee, Chewook and Cho, Minhaeng},
323     Date-Added = {2014-02-18 18:20:28 +0000},
324 gezelter 4042 Date-Modified = {2014-02-21 18:34:13 +0000},
325 gezelter 4028 Doi = {http://dx.doi.org/10.1063/1.2844787},
326     Eid = 134506,
327 gezelter 4097 Journal = {J. Chem. Phys.},
328 gezelter 4028 Number = {13},
329 gezelter 4042 Pages = {134506},
330 gezelter 4028 Title = {Nitrile and thiocyanate IR probes: Quantum chemistry calculation studies and multivariate least-square fitting analysis},
331     Url = {http://scitation.aip.org/content/aip/journal/jcp/128/13/10.1063/1.2844787},
332     Volume = {128},
333     Year = {2008},
334     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/128/13/10.1063/1.2844787},
335     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.2844787}}
336    
337     @article{Fafarman:2010dq,
338     Author = {Fafarman, Aaron T. and Sigala, Paul A. and Herschlag, Daniel and Boxer, Steven G.},
339     Date-Added = {2014-02-18 18:13:20 +0000},
340     Date-Modified = {2014-02-18 18:13:20 +0000},
341     Doi = {10.1021/ja104573b},
342     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja104573b},
343 gezelter 4097 Journal = {J. Am. Chem. Soc.},
344 gezelter 4028 Number = {37},
345     Pages = {12811-12813},
346     Title = {Decomposition of Vibrational Shifts of Nitriles into Electrostatic and Hydrogen-Bonding Effects},
347     Url = {http://pubs.acs.org/doi/abs/10.1021/ja104573b},
348     Volume = {132},
349     Year = {2010},
350     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja104573b},
351     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja104573b}}
352    
353     @article{Lindquist:2008bh,
354     Author = {Lindquist, Beth A. and Haws, Ryan T. and Corcelli, Steven A.},
355     Date-Added = {2014-02-18 16:27:15 +0000},
356 gezelter 4097 Date-Modified = {2014-04-01 19:42:06 +0000},
357 gezelter 4028 Doi = {10.1021/jp804900u},
358     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp804900u},
359 gezelter 4097 Journal = {J. Phys. Chem. B},
360 gezelter 4028 Number = {44},
361     Pages = {13991-14001},
362     Title = {Optimized Quantum Mechanics/Molecular Mechanics Strategies for Nitrile Vibrational Probes: Acetonitrile and para-Tolunitrile in Water and Tetrahydrofuran},
363     Url = {http://pubs.acs.org/doi/abs/10.1021/jp804900u},
364     Volume = {112},
365     Year = {2008},
366     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp804900u},
367     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp804900u}}
368    
369     @article{Lindquist:2008qf,
370     Author = {Lindquist, Beth A. and Corcelli, Steven A.},
371     Date-Added = {2014-02-18 16:26:29 +0000},
372 gezelter 4097 Date-Modified = {2014-04-01 19:42:14 +0000},
373 gezelter 4028 Doi = {10.1021/jp802039e},
374     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp802039e},
375 gezelter 4097 Journal = {J. Phys. Chem. B},
376 gezelter 4028 Number = {20},
377     Pages = {6301-6303},
378 gezelter 4042 Title = {Nitrile Groups as Vibrational Probes: Calculations of the CN Infrared Absorption Line Shape of Acetonitrile in Water and Tetrahydrofuran},
379 gezelter 4028 Url = {http://pubs.acs.org/doi/abs/10.1021/jp802039e},
380     Volume = {112},
381     Year = {2008},
382     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp802039e},
383     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp802039e}}
384    
385     @article{Waegele:2010ve,
386     Author = {Waegele, Matthias M. and Gai, Feng},
387     Date-Added = {2014-02-18 16:24:37 +0000},
388     Date-Modified = {2014-02-18 16:24:37 +0000},
389     Doi = {10.1021/jz900429z},
390     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jz900429z},
391 gezelter 4097 Journal = {J. Phys. Chem. Lett.},
392 gezelter 4028 Number = {4},
393     Pages = {781-786},
394     Title = {Computational Modeling of the Nitrile Stretching Vibration of 5-Cyanoindole in Water},
395     Url = {http://pubs.acs.org/doi/abs/10.1021/jz900429z},
396     Volume = {1},
397     Year = {2010},
398     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jz900429z},
399     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jz900429z}}
400    
401     @article{Leyte:1997zl,
402     Abstract = {Time-resolved (TR) spectra of 5CB in the millisecond domain were obtained during excitation with electric fields of different time dependence: ac, dc, and ac $+$ dc. The response to ac excitation occurs mainly at twice the modulating frequency. The effect of the addition of dc to an ac field is the induction of an additional response at the ac frequency. The additional 'single frequency' response persists indefinitely, even though the response to the application of only a permanent dc field relaxes within roughly 200 ms. The amplitude of the oscillating responses diminishes with increasing ac frequency. This result is in accordance with the expected response to the torque exerted by the ac field. Different functional group absorptions respond without a significant phase difference in this time scale.},
403     Author = {J. C. Leyte and P. C. M. Van Woerkom},
404     Date-Added = {2014-02-18 16:19:03 +0000},
405 gezelter 4042 Date-Modified = {2014-02-21 18:35:10 +0000},
406 gezelter 4028 Journal = {Appl. Spectrosc.},
407     Month = {Nov},
408     Number = {11},
409     Pages = {1711--1714},
410     Publisher = {OSA},
411 gezelter 4042 Title = {FT-IR TRS of Liquid Crystalline 5CB in AC, DC, and AC $+$ DC Electric Fields},
412 gezelter 4028 Url = {http://as.osa.org/abstract.cfm?URI=as-51-11-1711},
413     Volume = {51},
414     Year = {1997},
415     Bdsk-Url-1 = {http://as.osa.org/abstract.cfm?URI=as-51-11-1711}}
416    
417     @article{Moreno-Razo:2012rz,
418     Annote = {10.1038/nature11084},
419     Author = {Moreno-Razo, J. A. and Sambriski, E. J. and Abbott, N. L. and Hernandez-Ortiz, J. P. and de Pablo, J. J.},
420     Date = {2012/05/03/print},
421     Date-Added = {2014-02-18 16:07:15 +0000},
422     Date-Modified = {2014-02-18 16:07:15 +0000},
423     Day = {03},
424     Isbn = {0028-0836},
425     Journal = {Nature},
426     L3 = {http://www.nature.com/nature/journal/v485/n7396/abs/nature11084.html#supplementary-information},
427     M3 = {10.1038/nature11084},
428     Month = {05},
429     Number = {7396},
430     Pages = {86--89},
431     Publisher = {Nature Publishing Group, a division of Macmillan Publishers Limited. All Rights Reserved.},
432     Title = {Liquid-crystal-mediated self-assembly at nanodroplet interfaces},
433     Ty = {JOUR},
434     Url = {http://dx.doi.org/10.1038/nature11084},
435     Volume = {485},
436     Year = {2012},
437     Bdsk-Url-1 = {http://dx.doi.org/10.1038/nature11084}}
438    
439     @article{Schkolnik:2012ty,
440     Author = {Schkolnik, Gal and Salewski, Johannes and Millo, Diego and Zebger, Ingo and Franzen, Stefan and Hildebrandt, Peter},
441     Date-Added = {2014-02-18 15:43:30 +0000},
442     Date-Modified = {2014-02-18 15:43:30 +0000},
443     Doi = {10.3390/ijms13067466},
444     Issn = {1422-0067},
445 gezelter 4097 Journal = {Int. J. Mol. Sci.},
446 gezelter 4028 Number = {6},
447     Pages = {7466--7482},
448     Pubmedid = {22837705},
449     Title = {Vibrational Stark Effect of the Electric-Field Reporter 4-Mercaptobenzonitrile as a Tool for Investigating Electrostatics at Electrode/SAM/Solution Interfaces},
450     Url = {http://www.mdpi.com/1422-0067/13/6/7466},
451     Volume = {13},
452     Year = {2012},
453     Bdsk-Url-1 = {http://www.mdpi.com/1422-0067/13/6/7466},
454     Bdsk-Url-2 = {http://dx.doi.org/10.3390/ijms13067466}}
455    
456     @article{Andrews:2000qv,
457     Author = {Andrews, Steven S. and Boxer, Steven G.},
458     Date-Added = {2014-02-18 15:39:01 +0000},
459     Date-Modified = {2014-02-18 15:39:01 +0000},
460     Doi = {10.1021/jp002242r},
461     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp002242r},
462 gezelter 4097 Journal = {J. Phys. Chem. A},
463 gezelter 4028 Number = {51},
464     Pages = {11853-11863},
465     Title = {Vibrational Stark Effects of Nitriles I. Methods and Experimental Results},
466     Url = {http://pubs.acs.org/doi/abs/10.1021/jp002242r},
467     Volume = {104},
468     Year = {2000},
469     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp002242r},
470     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp002242r}}
471    
472     @article{Oklejas:2002uq,
473     Author = {Oklejas, Vanessa and Sjostrom, Chris and Harris, Joel M.},
474     Date-Added = {2014-02-18 15:24:01 +0000},
475     Date-Modified = {2014-02-18 15:24:01 +0000},
476     Doi = {10.1021/ja017656s},
477     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja017656s},
478 gezelter 4097 Journal = {J. Am. Chem. Soc.},
479 gezelter 4028 Number = {11},
480     Pages = {2408-2409},
481     Title = {SERS Detection of the Vibrational Stark Effect from Nitrile-Terminated SAMs to Probe Electric Fields in the Diffuse Double-Layer},
482     Url = {http://pubs.acs.org/doi/abs/10.1021/ja017656s},
483     Volume = {124},
484     Year = {2002},
485     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja017656s},
486     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja017656s}}
487    
488     @article{Lindquist:2009fk,
489     Abstract = {This paper presents an overview of recent experiments and theoretical developments aimed at using vibrational spectroscopy to understand the structure and dynamics of nitrile-labeled biomolecules. Nitrile groups are excellent vibrational probes of proteins and DNA because they absorb in a region of the spectrum that is relatively free of absorption due to the biomolecule{,} and they have high extinction coefficients. The vibrational frequency of nitrile groups is also extraordinarily sensitive to its local environment{,} and thus C[triple bond{,} length as m-dash]N bonds have been employed in both linear and 2-D infrared (IR) spectroscopy experiments and also as vibrational Stark probes of electric fields in proteins. The interpretation and design of these experiments would be enhanced by accurate calculations of IR spectra from molecular dynamics simulations. Recently{,} theoretical developments towards computing the vibrational spectrum of nitrile groups in the condensed-phase have been highly successful. A strong synergy between experiment and theory will further promote the use of vibrational spectroscopy of nitrile-labeled biomolecules to address fundamental questions of structure and dynamics that are elusive to other techniques.},
490     Author = {Lindquist, Beth A. and Furse, Kristina E. and Corcelli, Steven A.},
491     Date-Added = {2014-02-18 15:16:38 +0000},
492     Date-Modified = {2014-02-18 15:16:38 +0000},
493     Doi = {10.1039/B908588B},
494     Issue = {37},
495     Journal = {Phys. Chem. Chem. Phys.},
496     Pages = {8119-8132},
497     Publisher = {The Royal Society of Chemistry},
498     Title = {Nitrile groups as vibrational probes of biomolecular structure and dynamics: an overview},
499     Url = {http://dx.doi.org/10.1039/B908588B},
500     Volume = {11},
501     Year = {2009},
502     Bdsk-Url-1 = {http://dx.doi.org/10.1039/B908588B}}
503    
504 gezelter 4027 @article{Meineke05,
505     Author = {M.~A. Meineke and C.~F. {Vardeman II} and T. Lin and C.~J. Fennell and J.~D. Gezelter},
506     Date-Added = {2014-02-14 19:21:43 +0000},
507     Date-Modified = {2014-02-14 19:21:43 +0000},
508     Journal = {J. Comp. Chem.},
509     Pages = {252-271},
510     Title = {$\mbox{OOPSE: A}$n Open Source Object-Oriented Parallel Simulation Engine for Molecular Dynamics},
511     Volume = 26,
512     Year = 2005}
513    
514     @article{Fennell:2006zl,
515     Abstract = {We investigate pairwise electrostatic interaction methods and show that there are viable computationally efficient (O(N)) alternatives to the Ewald summation for typical modern molecular simulations. These methods are extended from the damped and cutoff-neutralized Coulombic sum originally proposed by Wolf [J. Chem. Phys. 110, 8255 (1999)]. One of these, the damped shifted force method, shows a remarkable ability to reproduce the energetic and dynamic characteristics exhibited by simulations employing lattice summation techniques. Comparisons were performed with this and other pairwise methods against the smooth particle-mesh Ewald summation to see how well they reproduce the energetics and dynamics of a variety of molecular simulations. (c) 2006 American Institute of Physics.},
516     Address = {CIRCULATION \& FULFILLMENT DIV, 2 HUNTINGTON QUADRANGLE, STE 1 N O 1, MELVILLE, NY 11747-4501 USA},
517     Author = {Fennell, Christopher~J. and Gezelter, J.~Daniel},
518     Date = {JUN 21 2006},
519     Date-Added = {2014-02-14 19:21:36 +0000},
520     Date-Modified = {2014-02-14 19:21:36 +0000},
521     Doi = {ARTN 234104},
522 gezelter 4091 Journal = {J. Chem. Phys.},
523 gezelter 4097 Pages = {234104},
524 gezelter 4027 Publisher = {AMER INST PHYSICS},
525     Timescited = {15},
526     Title = {Is the {E}wald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics},
527     Volume = {124},
528     Year = {2006},
529     Bdsk-Url-1 = {http://dx.doi.org/234104}}
530    
531 jmarr 4025 @article{PhysRevLett.111.227801,
532     Author = {Whitmer, Jonathan K. and Wang, Xiaoguang and Mondiot, Frederic and Miller, Daniel S. and Abbott, Nicholas L. and de Pablo, Juan J.},
533     Date-Added = {2014-02-06 20:01:25 +0000},
534     Date-Modified = {2014-02-06 20:01:25 +0000},
535     Doi = {10.1103/PhysRevLett.111.227801},
536     Issue = {22},
537     Journal = {Phys. Rev. Lett.},
538     Month = {Nov},
539     Numpages = {5},
540     Pages = {227801},
541     Publisher = {American Physical Society},
542     Title = {Nematic-Field-Driven Positioning of Particles in Liquid Crystal Droplets},
543     Url = {http://link.aps.org/doi/10.1103/PhysRevLett.111.227801},
544     Volume = {111},
545     Year = {2013},
546     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.111.227801},
547     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.111.227801}}
548    
549 jmarr 4024 @article{Oh:2008fk,
550     Abstract = {Nitrile- and thiocyanate-derivatized amino acids have been found to be useful IR probes for investigating their local electrostatic environments in proteins. To shed light on the CN stretch frequency shift and spectral lineshape change induced by interactions with hydrogen-bonding solvent molecules, we carried out both classical and quantum mechanical/molecular mechanical (QM/MM) molecular dynamics (MD) simulations for MeCN and MeSCN in water. These QM/MM and conventional force field MD simulation results were found to be inconsistent with the experimental results as well as with the high-level ab initio calculation results of MeCN-water and MeSCN-water potential energies. Thus, a new set of atomic partial charges of MeCN and MeSCN is obtained. By using the MD simulation trajectories and the electrostatic potential model recently developed, the CN and SCN stretching mode frequency trajectories were obtained and used to simulate the IR spectra. The C[Triple Bond]N frequency blueshifts of MeCN and MeSCN in water are estimated to be 9.0 and 1.9 cm(-1), respectively, in comparison with those of gas phase values. These values are found to be in reasonable agreement with the experimentally measured IR spectra of MeCN, MeSCN, beta-cyano-L-alanine, and cyanylated cysteine in water and other polar solvents.},
551     Author = {Oh, Kwang-Im and Choi, Jun-Ho and Lee, Joo-Hyun and Han, Jae-Beom and Lee, Hochan and Cho, Minhaeng},
552     Date-Added = {2014-02-06 18:11:52 +0000},
553     Date-Modified = {2014-02-06 18:11:52 +0000},
554     Doi = {10.1063/1.2904558},
555 gezelter 4097 Journal = {J. Chem. Phys.},
556 jmarr 4024 Journal-Full = {The Journal of chemical physics},
557     Month = {Apr},
558     Number = {15},
559     Pages = {154504},
560     Pmid = {18433232},
561     Pst = {ppublish},
562     Title = {Nitrile and thiocyanate IR probes: molecular dynamics simulation studies},
563     Volume = {128},
564     Year = {2008},
565     Bdsk-File-1 = {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}}
566    
567 gezelter 4007 @article{Gray:1973ca,
568     Author = {Gray, G.W. and Harrison, K.J. and Nash, J.A.},
569     Date-Added = {2014-01-20 19:18:33 +0000},
570     Date-Modified = {2014-01-20 19:18:35 +0000},
571     Doi = {10.1049/el:19730096},
572     Issn = {0013-5194},
573 gezelter 4097 Journal = {Electronics Lett.},
574 gezelter 4007 Keywords = {display systems;electro-optical effects;liquid crystals;displays;nematic liquid crystals;positive dielectric anisotropy},
575     Number = {6},
576     Pages = {130-131},
577     Title = {New family of nematic liquid crystals for displays},
578     Volume = {9},
579     Year = {1973},
580     Bdsk-Url-1 = {http://dx.doi.org/10.1049/el:19730096}}
581    
582     @article{Lee:2006qd,
583     Author = {Lee, Lay Min and Kwon, Hye J. and Kang, Joo H. and Nuzzo, Ralph G. and Schweizer, Kenneth S.},
584     Date-Added = {2014-01-20 19:14:33 +0000},
585     Date-Modified = {2014-01-20 19:39:28 +0000},
586     Doi = {http://dx.doi.org/10.1063/1.2210930},
587     Eid = 024705,
588 gezelter 4097 Journal = {J. Chem. Phys.},
589 gezelter 4007 Number = {2},
590     Pages = {024705},
591     Title = {Anchoring and electro-optical dynamics of thin liquid crystalline films in a polyimide cell: Experiment and theory},
592     Url = {http://scitation.aip.org/content/aip/journal/jcp/125/2/10.1063/1.2210930},
593     Volume = {125},
594     Year = {2006},
595     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/125/2/10.1063/1.2210930},
596     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.2210930}}
597    
598     @article{Zhang:2011hh,
599     Author = {Zhang, Jianguo and Su, Jiaye and Guo, Hongxia},
600     Date-Added = {2014-01-20 19:13:11 +0000},
601     Date-Modified = {2014-01-20 19:39:44 +0000},
602     Doi = {10.1021/jp111408n},
603     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp111408n},
604 gezelter 4097 Journal = {J. Phys. Chem. B},
605 gezelter 4007 Number = {10},
606     Pages = {2214-2227},
607     Title = {An Atomistic Simulation for 4-Cyano-4$^\prime$-pentylbiphenyl and Its Homologue with a Reoptimized Force Field},
608     Url = {http://pubs.acs.org/doi/abs/10.1021/jp111408n},
609     Volume = {115},
610     Year = {2011},
611     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp111408n},
612     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp111408n}}
613    
614     @article{Lim:2006xq,
615     Author = {Jong Kuk Lim and Ohyun Kwon and Dae Seung Kang and Sang-Woo Joo},
616     Date-Added = {2014-01-20 19:11:44 +0000},
617     Date-Modified = {2014-01-20 19:38:40 +0000},
618     Doi = {http://dx.doi.org/10.1016/j.cplett.2006.03.055},
619     Issn = {0009-2614},
620 gezelter 4097 Journal = {Chem. Phys. Lett.},
621 gezelter 4007 Number = {1--3},
622     Pages = {178 - 182},
623     Title = {Raman spectroscopy study and density functional theory calculations of the nematic liquid crystal 4-n-pentyl-4$^\prime$-cyanobiphenyl under an electric field},
624     Url = {http://www.sciencedirect.com/science/article/pii/S0009261406003873},
625     Volume = {423},
626     Year = {2006},
627     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/S0009261406003873},
628     Bdsk-Url-2 = {http://dx.doi.org/10.1016/j.cplett.2006.03.055}}
629    
630     @article{Tucker:2004qq,
631     Author = {Tucker, Matthew J. and Getahun, Zelleka and Nanda, Vikas and DeGrado, William F. and Gai, Feng},
632     Date-Added = {2014-01-20 19:10:42 +0000},
633     Date-Modified = {2014-01-20 19:10:45 +0000},
634     Doi = {10.1021/ja032015d},
635     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja032015d},
636 gezelter 4097 Journal = {J. Am. Chem. Soc.},
637 gezelter 4007 Number = {16},
638     Pages = {5078-5079},
639     Title = {A New Method for Determining the Local Environment and Orientation of Individual Side Chains of Membrane-Binding Peptides},
640     Url = {http://pubs.acs.org/doi/abs/10.1021/ja032015d},
641     Volume = {126},
642     Year = {2004},
643     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja032015d},
644     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja032015d}}
645    
646     @article{Webb:2008kn,
647     Author = {Webb, Lauren J. and Boxer, Steven G.},
648     Date-Added = {2014-01-20 19:09:37 +0000},
649 gezelter 4097 Date-Modified = {2014-04-01 19:42:25 +0000},
650 gezelter 4007 Doi = {10.1021/bi701708u},
651     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/bi701708u},
652     Journal = {Biochemistry},
653     Number = {6},
654     Pages = {1588-1598},
655     Title = {Electrostatic Fields Near the Active Site of Human Aldose Reductase: 1. New Inhibitors and Vibrational Stark Effect Measurements},
656     Url = {http://pubs.acs.org/doi/abs/10.1021/bi701708u},
657     Volume = {47},
658     Year = {2008},
659     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/bi701708u},
660     Bdsk-Url-2 = {http://dx.doi.org/10.1021/bi701708u}}
661    
662     @article{Boxer:2009xw,
663     Author = {Boxer, Steven G.},
664     Date-Added = {2014-01-20 19:07:47 +0000},
665     Date-Modified = {2014-01-20 19:37:48 +0000},
666     Doi = {10.1021/jp8067393},
667     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp8067393},
668 gezelter 4097 Journal = {J. Phys. Chem. B},
669 gezelter 4007 Number = {10},
670     Pages = {2972-2983},
671     Title = {Stark Realities},
672     Url = {http://pubs.acs.org/doi/abs/10.1021/jp8067393},
673     Volume = {113},
674     Year = {2009},
675     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp8067393},
676     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp8067393}}
677    
678     @article{Hatta:1991ee,
679     Author = {A. Hatta and H. Amano and W. Su{\"e}taka},
680     Date-Added = {2014-01-20 19:05:00 +0000},
681     Date-Modified = {2014-01-20 19:05:03 +0000},
682     Doi = {http://dx.doi.org/10.1016/0924-2031(91)80006-A},
683     Issn = {0924-2031},
684     Journal = {Vibrational Spectroscopy},
685     Keywords = {Liquid crystals},
686     Number = {4},
687     Pages = {371 - 376},
688     Title = {Electric field response of 5CB liquid crystal molecules in the electrode boundary region as probed by modulation infrared \{ATR\} spectroscopy},
689     Url = {http://www.sciencedirect.com/science/article/pii/092420319180006A},
690     Volume = {1},
691     Year = {1991},
692     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/092420319180006A},
693     Bdsk-Url-2 = {http://dx.doi.org/10.1016/0924-2031(91)80006-A}}
694    
695     @incollection{Prost:1980wt,
696     Author = {Prost, J.},
697     Booktitle = {Liquid Crystals of One- and Two-Dimensional Order},
698     Date-Added = {2014-01-20 19:01:37 +0000},
699     Date-Modified = {2014-01-20 19:01:41 +0000},
700     Doi = {10.1007/978-3-642-67848-6_29},
701     Editor = {Helfrich, W. and Heppke, G.},
702     Isbn = {978-3-642-67850-9},
703     Language = {English},
704     Pages = {125-145},
705     Publisher = {Springer Berlin Heidelberg},
706     Series = {Springer Series in Chemical Physics},
707     Title = {Reflections on the Reentrant Nematic and the SA-SA Phase Transitions},
708     Url = {http://dx.doi.org/10.1007/978-3-642-67848-6_29},
709     Volume = {11},
710     Year = {1980},
711     Bdsk-Url-1 = {http://dx.doi.org/10.1007/978-3-642-67848-6_29}}
712    
713     @article{HARDOUIN:1983qf,
714     Author = {HARDOUIN, F and LEVELUT, AM and ACHARD, MF and SIGAUD, G},
715     Date-Added = {2014-01-20 18:56:21 +0000},
716     Date-Modified = {2014-01-20 18:56:21 +0000},
717     Issn = {{0021-7689}},
718     Journal = {{JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE}},
719     Number = {{1}},
720     Pages = {{53-64}},
721     Title = {{POLYMORPHISM IN POLAR MESOGENS .1. PHYSICO-CHEMISTRY AND STRUCTURAL ASPECTS}},
722     Unique-Id = {{ISI:A1983QJ60700008}},
723     Volume = {{80}},
724     Year = {{1983}}}
725    
726     @article{Leadbetter:1976vf,
727     Author = {Leadbetter, A. J. and Durrant, J. L. A. and Rugman, M.},
728     Date-Added = {2014-01-20 18:54:50 +0000},
729     Date-Modified = {2014-01-20 18:54:54 +0000},
730     Doi = {10.1080/15421407708083712},
731     Eprint = {http://www.tandfonline.com/doi/pdf/10.1080/15421407708083712},
732     Journal = {Molecular Crystals and Liquid Crystals},
733     Number = {10},
734     Pages = {231-235},
735     Title = {The Density Of 4 n-Octyl-4-Cyano-Biphenyl (8CB)},
736     Url = {http://www.tandfonline.com/doi/abs/10.1080/15421407708083712},
737     Volume = {34},
738     Year = {1976},
739     Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/15421407708083712},
740     Bdsk-Url-2 = {http://dx.doi.org/10.1080/15421407708083712}}
741    
742     @book{Gray:1984hc,
743     Author = {Gray, G.W. and Goodby, J.W.G.},
744     Date-Added = {2014-01-20 18:39:08 +0000},
745     Date-Modified = {2014-01-20 18:39:08 +0000},
746     Isbn = {9780249441680},
747     Lccn = {lc84164554},
748     Publisher = {L. Hill},
749     Title = {Smectic liquid crystals: textures and structures},
750     Url = {http://books.google.com/books?id=WgTwAAAAMAAJ},
751     Year = {1984},
752     Bdsk-Url-1 = {http://books.google.com/books?id=WgTwAAAAMAAJ}}
753    
754     @article{Vanakaras:1998it,
755     Author = {Vanakaras, Alexandros G. and Photinos, Demetri J. and Samulski, Edward T.},
756     Date-Added = {2014-01-20 18:37:13 +0000},
757     Date-Modified = {2014-01-20 18:37:15 +0000},
758     Doi = {10.1103/PhysRevE.57.R4875},
759     Issue = {5},
760     Journal = {Phys. Rev. E},
761     Month = {May},
762     Numpages = {0},
763     Pages = {R4875--R4878},
764     Publisher = {American Physical Society},
765     Title = {Tilt, polarity, and spontaneous symmetry breaking in liquid crystals},
766     Url = {http://link.aps.org/doi/10.1103/PhysRevE.57.R4875},
767     Volume = {57},
768     Year = {1998},
769     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.57.R4875},
770     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.57.R4875}}
771    
772     @article{Prost:1984qe,
773     Author = {Prost, J.},
774     Date-Added = {2014-01-20 18:36:25 +0000},
775     Date-Modified = {2014-01-20 18:36:29 +0000},
776     Doi = {10.1080/00018738400101631},
777     Eprint = {http://www.tandfonline.com/doi/pdf/10.1080/00018738400101631},
778     Journal = {Advances in Physics},
779     Number = {1},
780     Pages = {1-46},
781     Title = {The smectic state},
782     Url = {http://www.tandfonline.com/doi/abs/10.1080/00018738400101631},
783     Volume = {33},
784     Year = {1984},
785     Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/00018738400101631},
786     Bdsk-Url-2 = {http://dx.doi.org/10.1080/00018738400101631}}
787    
788     @article{Photinos:1976xe,
789     Author = {Photinos, Panagoitis J. and Saupe, Alfred},
790     Date-Added = {2014-01-20 18:34:10 +0000},
791     Date-Modified = {2014-01-20 18:34:14 +0000},
792     Doi = {10.1103/PhysRevA.13.1926},
793     Issue = {5},
794     Journal = {Phys. Rev. A},
795     Month = {May},
796     Numpages = {0},
797     Pages = {1926--1930},
798     Publisher = {American Physical Society},
799     Title = {Mean-field study of uniaxial smectic liquid crystals with polarized layers},
800     Url = {http://link.aps.org/doi/10.1103/PhysRevA.13.1926},
801     Volume = {13},
802     Year = {1976},
803     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.13.1926},
804     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.13.1926}}
805    
806     @article{Netz:1992cr,
807     Author = {Netz, Roland R. and Berker, A. Nihat},
808     Date-Added = {2014-01-20 18:33:40 +0000},
809     Date-Modified = {2014-01-20 18:33:43 +0000},
810     Doi = {10.1103/PhysRevLett.68.333},
811     Issue = {3},
812     Journal = {Phys. Rev. Lett.},
813     Month = {Jan},
814     Numpages = {0},
815     Pages = {333--336},
816     Publisher = {American Physical Society},
817     Title = {Smectic-<i>C</i> order, in-plane domains, and nematic reentrance in a microscopic model of liquid crystals},
818     Url = {http://link.aps.org/doi/10.1103/PhysRevLett.68.333},
819     Volume = {68},
820     Year = {1992},
821     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.68.333},
822     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.68.333}}
823    
824     @article{Meyer:1976qd,
825     Author = {Meyer, Robert B. and Lubensky, T. C.},
826     Date-Added = {2014-01-20 18:33:13 +0000},
827     Date-Modified = {2014-01-20 19:12:04 +0000},
828     Doi = {10.1103/PhysRevA.14.2307},
829     Issue = {6},
830     Journal = {Phys. Rev. A},
831     Month = {Dec},
832     Numpages = {0},
833     Pages = {2307--2320},
834     Publisher = {American Physical Society},
835     Title = {Mean-field theory of the nematic-smectic-A phase change in liquid crystals},
836     Url = {http://link.aps.org/doi/10.1103/PhysRevA.14.2307},
837     Volume = {14},
838     Year = {1976},
839     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.14.2307},
840     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.14.2307}}
841    
842     @article{Levesque:1993pd,
843     Author = {Levesque, D. and Weis, J. J. and Zarragoicoechea, G. J.},
844     Date-Added = {2014-01-20 18:32:43 +0000},
845     Date-Modified = {2014-01-20 18:32:45 +0000},
846     Doi = {10.1103/PhysRevE.47.496},
847     Issue = {1},
848     Journal = {Phys. Rev. E},
849     Month = {Jan},
850     Numpages = {0},
851     Pages = {496--505},
852     Publisher = {American Physical Society},
853     Title = {Monte Carlo simulation study of mesophase formation in dipolar spherocylinders},
854     Url = {http://link.aps.org/doi/10.1103/PhysRevE.47.496},
855     Volume = {47},
856     Year = {1993},
857     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.47.496},
858     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.47.496}}
859    
860     @article{Levelut:1981eu,
861     Author = {Levelut, A. M. and Tarento, R. J. and Hardouin, F. and Achard, M. F. and Sigaud, G.},
862     Date-Added = {2014-01-20 18:32:07 +0000},
863 gezelter 4042 Date-Modified = {2014-02-21 18:30:08 +0000},
864 gezelter 4007 Doi = {10.1103/PhysRevA.24.2180},
865     Issue = {4},
866     Journal = {Phys. Rev. A},
867     Month = {Oct},
868     Numpages = {0},
869     Pages = {2180--2186},
870     Publisher = {American Physical Society},
871 gezelter 4042 Title = {Number of $S_A$ phases},
872 gezelter 4007 Url = {http://link.aps.org/doi/10.1103/PhysRevA.24.2180},
873     Volume = {24},
874     Year = {1981},
875     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.24.2180},
876     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.24.2180}}
877    
878     @article{Jeu:1983ly,
879     Abstract = {The physical properties and the phase behaviour of some nematic liquid crystals are discussed, with emphasis on the influence of short-range antiparallel dipole correlation that occurs in mesogenic compounds with a strong terminal dipole moment. Evidence for this effect, which stems especially from dielectric studies, is summarized. Variations of the dipole correlation with molecular structure can explain the sometimes unexpected phase behaviour and physical properties of these substances. A qualitative model is given in terms of a monomer--dimer equilibrium.},
880     Author = {Jeu, W. H. De and Raynes, E. P. and Price, A. H. and Clark, M. G.},
881     Date-Added = {2014-01-20 18:30:36 +0000},
882     Date-Modified = {2014-01-20 18:30:39 +0000},
883     Doi = {10.1098/rsta.1983.0035},
884     Eprint = {http://rsta.royalsocietypublishing.org/content/309/1507/217.full.pdf+html},
885     Journal = {Philosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences},
886     Number = {1507},
887     Pages = {217-229},
888     Title = {Liquid Crystalline Materials: Physical Properties and Intermolecular Interactions [and Discussion]},
889     Url = {http://rsta.royalsocietypublishing.org/content/309/1507/217.abstract},
890     Volume = {309},
891     Year = {1983},
892     Bdsk-Url-1 = {http://rsta.royalsocietypublishing.org/content/309/1507/217.abstract},
893     Bdsk-Url-2 = {http://dx.doi.org/10.1098/rsta.1983.0035}}
894    
895     @article{Indekeu:1986ty,
896     Author = {Indekeu, J. O. and Berker, A. Nihat},
897     Date-Added = {2014-01-20 18:27:51 +0000},
898     Date-Modified = {2014-01-20 18:50:31 +0000},
899     Doi = {10.1103/PhysRevA.33.1158},
900     Issue = {2},
901     Journal = {Phys. Rev. A},
902     Month = {Feb},
903     Numpages = {0},
904     Pages = {1158--1162},
905     Publisher = {American Physical Society},
906     Title = {Quadruple reentrance (nematic-smectic-Ad-nematic-smectic-Ad-nematic-smectic-A1) from the frustrated spin-gas model of liquid crystals},
907     Url = {http://link.aps.org/doi/10.1103/PhysRevA.33.1158},
908     Volume = {33},
909     Year = {1986},
910     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.33.1158},
911     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.33.1158}}
912    
913     @incollection{Hardouin:1980yq,
914     Author = {Hardouin, F. and Levelut, A.M. and Benattar, J.J. and Sigaud, G.},
915     Booktitle = {Liquid Crystals of One- and Two-Dimensional Order},
916     Date-Added = {2014-01-20 18:26:57 +0000},
917     Date-Modified = {2014-01-20 18:26:59 +0000},
918     Doi = {10.1007/978-3-642-67848-6_31},
919     Editor = {Helfrich, W. and Heppke, G.},
920     Isbn = {978-3-642-67850-9},
921     Language = {English},
922     Pages = {147-147},
923     Publisher = {Springer Berlin Heidelberg},
924     Series = {Springer Series in Chemical Physics},
925     Title = {X-Ray Investigations of the Smectic A1 --- Smectic A2 Transition},
926     Url = {http://dx.doi.org/10.1007/978-3-642-67848-6_31},
927     Volume = {11},
928     Year = {1980},
929     Bdsk-Url-1 = {http://dx.doi.org/10.1007/978-3-642-67848-6_31}}
930    
931     @article{Dowell:1985qf,
932     Author = {Dowell, F.},
933     Date-Added = {2014-01-20 18:25:24 +0000},
934     Date-Modified = {2014-01-20 18:25:26 +0000},
935     Doi = {10.1103/PhysRevA.31.3214},
936     Issue = {5},
937     Journal = {Phys. Rev. A},
938     Month = {May},
939     Numpages = {0},
940     Pages = {3214--3219},
941     Publisher = {American Physical Society},
942     Title = {Effect of longitudinal dipoles in liquid crystals},
943     Url = {http://link.aps.org/doi/10.1103/PhysRevA.31.3214},
944     Volume = {31},
945     Year = {1985},
946     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.31.3214},
947     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.31.3214}}
948    
949     @article{Baus:1989fk,
950     Author = {Baus, Marc and Colot, Jean-Louis},
951     Date-Added = {2014-01-20 18:24:36 +0000},
952     Date-Modified = {2014-01-20 18:24:39 +0000},
953     Doi = {10.1103/PhysRevA.40.5444},
954     Issue = {9},
955     Journal = {Phys. Rev. A},
956     Month = {Nov},
957     Numpages = {0},
958     Pages = {5444--5446},
959     Publisher = {American Physical Society},
960     Title = {Ferroelectric nematic liquid-crystal phases of dipolar hard ellipsoids},
961     Url = {http://link.aps.org/doi/10.1103/PhysRevA.40.5444},
962     Volume = {40},
963     Year = {1989},
964     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.40.5444},
965     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.40.5444}}