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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 4040 %% Created for Dan Gezelter at 2014-02-21 09:18:13 -0500
6 gezelter 4007
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8     %% Saved with string encoding Unicode (UTF-8)
9    
10    
11    
12 gezelter 4040 @article{Bose:2012eu,
13     Author = {Bose, Tushar Kanti and Saha, Jayashree},
14     Date-Added = {2014-02-21 14:00:07 +0000},
15     Date-Modified = {2014-02-21 14:00:07 +0000},
16     Doi = {10.1103/PhysRevE.86.050701},
17     Issue = {5},
18     Journal = {Phys. Rev. E},
19     Month = {Nov},
20     Numpages = {4},
21     Pages = {050701},
22     Publisher = {American Physical Society},
23     Title = {Origin of tilted-phase generation in systems of ellipsoidal molecules with dipolar interactions},
24     Url = {http://link.aps.org/doi/10.1103/PhysRevE.86.050701},
25     Volume = {86},
26     Year = {2012},
27     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.86.050701},
28     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.86.050701}}
29    
30 gezelter 4036 @article{FILLER:1964yg,
31     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.},
32     Author = {A. S. FILLER},
33     Date-Added = {2014-02-20 18:13:39 +0000},
34     Date-Modified = {2014-02-20 18:13:39 +0000},
35     Doi = {10.1364/JOSA.54.000762},
36     Journal = {J. Opt. Soc. Am.},
37     Month = {Jun},
38     Number = {6},
39     Pages = {762--764},
40     Publisher = {OSA},
41     Title = {Apodization and Interpolation in Fourier-Transform Spectroscopy},
42     Url = {http://www.opticsinfobase.org/abstract.cfm?URI=josa-54-6-762},
43     Volume = {54},
44     Year = {1964},
45     Bdsk-Url-1 = {http://www.opticsinfobase.org/abstract.cfm?URI=josa-54-6-762},
46     Bdsk-Url-2 = {http://dx.doi.org/10.1364/JOSA.54.000762}}
47    
48     @article{Naylor:2007rm,
49     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.},
50     Author = {David A. Naylor and Margaret K. Tahic},
51     Date-Added = {2014-02-20 16:45:24 +0000},
52     Date-Modified = {2014-02-20 16:45:24 +0000},
53     Doi = {10.1364/JOSAA.24.003644},
54     Journal = {J. Opt. Soc. Am. A},
55     Keywords = {Linewidth; Spectroscopy, Fourier transforms},
56     Month = {Nov},
57     Number = {11},
58     Pages = {3644--3648},
59     Publisher = {OSA},
60     Title = {Apodizing functions for Fourier transform spectroscopy},
61     Url = {http://josaa.osa.org/abstract.cfm?URI=josaa-24-11-3644},
62     Volume = {24},
63     Year = {2007},
64     Bdsk-Url-1 = {http://josaa.osa.org/abstract.cfm?URI=josaa-24-11-3644},
65     Bdsk-Url-2 = {http://dx.doi.org/10.1364/JOSAA.24.003644}}
66    
67 gezelter 4035 @article{Morse:1929xy,
68     Author = {Morse, Philip M.},
69     Date-Added = {2014-02-19 21:18:41 +0000},
70     Date-Modified = {2014-02-19 21:18:43 +0000},
71     Doi = {10.1103/PhysRev.34.57},
72     Issue = {1},
73     Journal = {Phys. Rev.},
74     Month = {Jul},
75     Numpages = {0},
76     Pages = {57--64},
77     Publisher = {American Physical Society},
78     Title = {Diatomic Molecules According to the Wave Mechanics. II. Vibrational Levels},
79     Url = {http://link.aps.org/doi/10.1103/PhysRev.34.57},
80     Volume = {34},
81     Year = {1929},
82     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRev.34.57},
83     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRev.34.57}}
84    
85     @article{Lee:1988qf,
86     Author = {Lee, Chengteh and Yang, Weitao and Parr, Robert G.},
87     Date-Added = {2014-02-19 21:03:16 +0000},
88     Date-Modified = {2014-02-19 21:03:19 +0000},
89     Doi = {10.1103/PhysRevB.37.785},
90     Issue = {2},
91     Journal = {Phys. Rev. B},
92     Month = {Jan},
93     Numpages = {0},
94     Pages = {785--789},
95     Publisher = {American Physical Society},
96     Title = {Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density},
97     Url = {http://link.aps.org/doi/10.1103/PhysRevB.37.785},
98     Volume = {37},
99     Year = {1988},
100     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.37.785},
101     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.37.785}}
102    
103     @article{Becke:1993kq,
104     Author = {Becke, Axel D.},
105     Date-Added = {2014-02-19 21:02:30 +0000},
106     Date-Modified = {2014-02-19 21:02:30 +0000},
107     Doi = {http://dx.doi.org/10.1063/1.464913},
108     Journal = {The Journal of Chemical Physics},
109     Number = {7},
110     Pages = {5648-5652},
111     Title = {Density‐functional thermochemistry. III. The role of exact exchange},
112     Url = {http://scitation.aip.org/content/aip/journal/jcp/98/7/10.1063/1.464913},
113     Volume = {98},
114     Year = {1993},
115     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/98/7/10.1063/1.464913},
116     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.464913}}
117    
118 gezelter 4028 @book{Collings:1997rz,
119     Author = {Collings, P.J. and Hird, M.},
120     Date-Added = {2014-02-18 21:05:20 +0000},
121     Date-Modified = {2014-02-18 21:05:20 +0000},
122     Isbn = {9780203211199},
123     Publisher = {Taylor \& Francis},
124     Series = {Liquid Crystals Book Series},
125     Title = {Introduction to Liquid Crystals: Chemistry and Physics},
126     Url = {http://books.google.com/books?id=GBeDkKpZ5VQC},
127     Year = {1997},
128     Bdsk-Url-1 = {http://books.google.com/books?id=GBeDkKpZ5VQC}}
129    
130     @article{Cleaver:1996rt,
131     Author = {Cleaver, Douglas J. and Care, Christopher M. and Allen, Michael P. and Neal, Maureen P.},
132     Date-Added = {2014-02-18 21:01:40 +0000},
133     Date-Modified = {2014-02-18 21:01:42 +0000},
134     Doi = {10.1103/PhysRevE.54.559},
135     Issue = {1},
136     Journal = {Phys. Rev. E},
137     Month = {Jul},
138     Numpages = {0},
139     Pages = {559--567},
140     Publisher = {American Physical Society},
141     Title = {Extension and generalization of the Gay-Berne potential},
142     Url = {http://link.aps.org/doi/10.1103/PhysRevE.54.559},
143     Volume = {54},
144     Year = {1996},
145     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.54.559},
146     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.54.559}}
147    
148     @article{Kushick:1976xy,
149     Author = {Kushick, J. and Berne, Bruce J.},
150     Date-Added = {2014-02-18 21:00:21 +0000},
151     Date-Modified = {2014-02-18 21:00:21 +0000},
152     Doi = {http://dx.doi.org/10.1063/1.432403},
153     Journal = {The Journal of Chemical Physics},
154     Number = {4},
155     Pages = {1362-1367},
156     Title = {Computer simulation of anisotropic molecular fluids},
157     Url = {http://scitation.aip.org/content/aip/journal/jcp/64/4/10.1063/1.432403},
158     Volume = {64},
159     Year = {1976},
160     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/64/4/10.1063/1.432403},
161     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.432403}}
162    
163     @article{Gay:1981yu,
164     Author = {Gay, J. G. and Berne, B. J.},
165     Date-Added = {2014-02-18 20:57:16 +0000},
166     Date-Modified = {2014-02-18 20:57:16 +0000},
167     Doi = {http://dx.doi.org/10.1063/1.441483},
168     Journal = {The Journal of Chemical Physics},
169     Number = {6},
170     Pages = {3316-3319},
171     Title = {Modification of the overlap potential to mimic a linear site--site potential},
172     Url = {http://scitation.aip.org/content/aip/journal/jcp/74/6/10.1063/1.441483},
173     Volume = {74},
174     Year = {1981},
175     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/74/6/10.1063/1.441483},
176     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.441483}}
177    
178     @article{Luckhurst90,
179     Author = {Luckhurst, G.~R. and Stephens, R.~A. and Phippen, R.~W.},
180     Date = OCT,
181     Date-Added = {2014-02-18 20:38:33 +0000},
182     Date-Modified = {2014-02-18 20:38:33 +0000},
183     Journal = lc,
184     Number = 4,
185     Pages = {451 - 464},
186     Title = {COMPUTER-SIMULATION STUDIES OF ANISOTROPIC SYSTEMS .19. MESOPHASES FORMED BY THE GAY-BERNE MODEL MESOGEN},
187     Volume = 8,
188     Year = 1990}
189    
190     @article{Berne72,
191     Author = {Berne, B.~J. and Pechukas, P},
192     Date-Added = {2014-02-18 20:38:09 +0000},
193     Date-Modified = {2014-02-18 20:38:09 +0000},
194     Journal = {Journal of Chemical Physics},
195     Number = 8,
196     Pages = {4213-4216},
197     Title = {Gaussian Model Potentials for Molecular Interactions},
198     Volume = 56,
199     Year = 1972}
200    
201     @article{Choi:2008cr,
202     Author = {Choi, Jun-Ho and Oh, Kwang-Im and Lee, Hochan and Lee, Chewook and Cho, Minhaeng},
203     Date-Added = {2014-02-18 18:20:28 +0000},
204     Date-Modified = {2014-02-18 18:20:28 +0000},
205     Doi = {http://dx.doi.org/10.1063/1.2844787},
206     Eid = 134506,
207     Journal = {The Journal of Chemical Physics},
208     Number = {13},
209     Pages = {-},
210     Title = {Nitrile and thiocyanate IR probes: Quantum chemistry calculation studies and multivariate least-square fitting analysis},
211     Url = {http://scitation.aip.org/content/aip/journal/jcp/128/13/10.1063/1.2844787},
212     Volume = {128},
213     Year = {2008},
214     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/128/13/10.1063/1.2844787},
215     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.2844787}}
216    
217     @article{Fafarman:2010dq,
218     Author = {Fafarman, Aaron T. and Sigala, Paul A. and Herschlag, Daniel and Boxer, Steven G.},
219     Date-Added = {2014-02-18 18:13:20 +0000},
220     Date-Modified = {2014-02-18 18:13:20 +0000},
221     Doi = {10.1021/ja104573b},
222     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja104573b},
223     Journal = {Journal of the American Chemical Society},
224     Number = {37},
225     Pages = {12811-12813},
226     Title = {Decomposition of Vibrational Shifts of Nitriles into Electrostatic and Hydrogen-Bonding Effects},
227     Url = {http://pubs.acs.org/doi/abs/10.1021/ja104573b},
228     Volume = {132},
229     Year = {2010},
230     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja104573b},
231     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja104573b}}
232    
233     @article{Lindquist:2008bh,
234     Author = {Lindquist, Beth A. and Haws, Ryan T. and Corcelli, Steven A.},
235     Date-Added = {2014-02-18 16:27:15 +0000},
236     Date-Modified = {2014-02-18 16:27:15 +0000},
237     Doi = {10.1021/jp804900u},
238     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp804900u},
239     Journal = {The Journal of Physical Chemistry B},
240     Note = {PMID: 18855431},
241     Number = {44},
242     Pages = {13991-14001},
243     Title = {Optimized Quantum Mechanics/Molecular Mechanics Strategies for Nitrile Vibrational Probes: Acetonitrile and para-Tolunitrile in Water and Tetrahydrofuran},
244     Url = {http://pubs.acs.org/doi/abs/10.1021/jp804900u},
245     Volume = {112},
246     Year = {2008},
247     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp804900u},
248     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp804900u}}
249    
250     @article{Lindquist:2008qf,
251     Author = {Lindquist, Beth A. and Corcelli, Steven A.},
252     Date-Added = {2014-02-18 16:26:29 +0000},
253     Date-Modified = {2014-02-18 16:26:29 +0000},
254     Doi = {10.1021/jp802039e},
255     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp802039e},
256     Journal = {The Journal of Physical Chemistry B},
257     Note = {PMID: 18438998},
258     Number = {20},
259     Pages = {6301-6303},
260     Title = {Nitrile Groups as Vibrational Probes: Calculations of the CN Infrared Absorption Line Shape of Acetonitrile in Water and Tetrahydrofuran},
261     Url = {http://pubs.acs.org/doi/abs/10.1021/jp802039e},
262     Volume = {112},
263     Year = {2008},
264     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp802039e},
265     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp802039e}}
266    
267     @article{Waegele:2010ve,
268     Author = {Waegele, Matthias M. and Gai, Feng},
269     Date-Added = {2014-02-18 16:24:37 +0000},
270     Date-Modified = {2014-02-18 16:24:37 +0000},
271     Doi = {10.1021/jz900429z},
272     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jz900429z},
273     Journal = {The Journal of Physical Chemistry Letters},
274     Number = {4},
275     Pages = {781-786},
276     Title = {Computational Modeling of the Nitrile Stretching Vibration of 5-Cyanoindole in Water},
277     Url = {http://pubs.acs.org/doi/abs/10.1021/jz900429z},
278     Volume = {1},
279     Year = {2010},
280     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jz900429z},
281     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jz900429z}}
282    
283     @article{Leyte:1997zl,
284     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.},
285     Author = {J. C. Leyte and P. C. M. Van Woerkom},
286     Date-Added = {2014-02-18 16:19:03 +0000},
287     Date-Modified = {2014-02-18 16:19:03 +0000},
288     Journal = {Appl. Spectrosc.},
289     Month = {Nov},
290     Number = {11},
291     Pages = {1711--1714},
292     Publisher = {OSA},
293     Title = {FT-IR TRS of Liquid Crystalline 5CB in ac, dc, and ac $+$ dc Electric Fields},
294     Url = {http://as.osa.org/abstract.cfm?URI=as-51-11-1711},
295     Volume = {51},
296     Year = {1997},
297     Bdsk-Url-1 = {http://as.osa.org/abstract.cfm?URI=as-51-11-1711}}
298    
299     @article{Moreno-Razo:2012rz,
300     Annote = {10.1038/nature11084},
301     Author = {Moreno-Razo, J. A. and Sambriski, E. J. and Abbott, N. L. and Hernandez-Ortiz, J. P. and de Pablo, J. J.},
302     Date = {2012/05/03/print},
303     Date-Added = {2014-02-18 16:07:15 +0000},
304     Date-Modified = {2014-02-18 16:07:15 +0000},
305     Day = {03},
306     Isbn = {0028-0836},
307     Journal = {Nature},
308     L3 = {http://www.nature.com/nature/journal/v485/n7396/abs/nature11084.html#supplementary-information},
309     M3 = {10.1038/nature11084},
310     Month = {05},
311     Number = {7396},
312     Pages = {86--89},
313     Publisher = {Nature Publishing Group, a division of Macmillan Publishers Limited. All Rights Reserved.},
314     Title = {Liquid-crystal-mediated self-assembly at nanodroplet interfaces},
315     Ty = {JOUR},
316     Url = {http://dx.doi.org/10.1038/nature11084},
317     Volume = {485},
318     Year = {2012},
319     Bdsk-Url-1 = {http://dx.doi.org/10.1038/nature11084}}
320    
321     @article{Schkolnik:2012ty,
322     Author = {Schkolnik, Gal and Salewski, Johannes and Millo, Diego and Zebger, Ingo and Franzen, Stefan and Hildebrandt, Peter},
323     Date-Added = {2014-02-18 15:43:30 +0000},
324     Date-Modified = {2014-02-18 15:43:30 +0000},
325     Doi = {10.3390/ijms13067466},
326     Issn = {1422-0067},
327     Journal = {International Journal of Molecular Sciences},
328     Number = {6},
329     Pages = {7466--7482},
330     Pubmedid = {22837705},
331     Title = {Vibrational Stark Effect of the Electric-Field Reporter 4-Mercaptobenzonitrile as a Tool for Investigating Electrostatics at Electrode/SAM/Solution Interfaces},
332     Url = {http://www.mdpi.com/1422-0067/13/6/7466},
333     Volume = {13},
334     Year = {2012},
335     Bdsk-Url-1 = {http://www.mdpi.com/1422-0067/13/6/7466},
336     Bdsk-Url-2 = {http://dx.doi.org/10.3390/ijms13067466}}
337    
338     @article{Andrews:2000qv,
339     Author = {Andrews, Steven S. and Boxer, Steven G.},
340     Date-Added = {2014-02-18 15:39:01 +0000},
341     Date-Modified = {2014-02-18 15:39:01 +0000},
342     Doi = {10.1021/jp002242r},
343     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp002242r},
344     Journal = {The Journal of Physical Chemistry A},
345     Number = {51},
346     Pages = {11853-11863},
347     Title = {Vibrational Stark Effects of Nitriles I. Methods and Experimental Results},
348     Url = {http://pubs.acs.org/doi/abs/10.1021/jp002242r},
349     Volume = {104},
350     Year = {2000},
351     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp002242r},
352     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp002242r}}
353    
354     @article{Oklejas:2002uq,
355     Author = {Oklejas, Vanessa and Sjostrom, Chris and Harris, Joel M.},
356     Date-Added = {2014-02-18 15:24:01 +0000},
357     Date-Modified = {2014-02-18 15:24:01 +0000},
358     Doi = {10.1021/ja017656s},
359     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja017656s},
360     Journal = {Journal of the American Chemical Society},
361     Number = {11},
362     Pages = {2408-2409},
363     Title = {SERS Detection of the Vibrational Stark Effect from Nitrile-Terminated SAMs to Probe Electric Fields in the Diffuse Double-Layer},
364     Url = {http://pubs.acs.org/doi/abs/10.1021/ja017656s},
365     Volume = {124},
366     Year = {2002},
367     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja017656s},
368     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja017656s}}
369    
370     @article{Lindquist:2009fk,
371     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.},
372     Author = {Lindquist, Beth A. and Furse, Kristina E. and Corcelli, Steven A.},
373     Date-Added = {2014-02-18 15:16:38 +0000},
374     Date-Modified = {2014-02-18 15:16:38 +0000},
375     Doi = {10.1039/B908588B},
376     Issue = {37},
377     Journal = {Phys. Chem. Chem. Phys.},
378     Pages = {8119-8132},
379     Publisher = {The Royal Society of Chemistry},
380     Title = {Nitrile groups as vibrational probes of biomolecular structure and dynamics: an overview},
381     Url = {http://dx.doi.org/10.1039/B908588B},
382     Volume = {11},
383     Year = {2009},
384     Bdsk-Url-1 = {http://dx.doi.org/10.1039/B908588B}}
385    
386 gezelter 4027 @article{Meineke05,
387     Author = {M.~A. Meineke and C.~F. {Vardeman II} and T. Lin and C.~J. Fennell and J.~D. Gezelter},
388     Date-Added = {2014-02-14 19:21:43 +0000},
389     Date-Modified = {2014-02-14 19:21:43 +0000},
390     Journal = {J. Comp. Chem.},
391     Pages = {252-271},
392     Title = {$\mbox{OOPSE: A}$n Open Source Object-Oriented Parallel Simulation Engine for Molecular Dynamics},
393     Volume = 26,
394     Year = 2005}
395    
396     @article{Fennell:2006zl,
397     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.},
398     Address = {CIRCULATION \& FULFILLMENT DIV, 2 HUNTINGTON QUADRANGLE, STE 1 N O 1, MELVILLE, NY 11747-4501 USA},
399     Author = {Fennell, Christopher~J. and Gezelter, J.~Daniel},
400     Date = {JUN 21 2006},
401     Date-Added = {2014-02-14 19:21:36 +0000},
402     Date-Modified = {2014-02-14 19:21:36 +0000},
403     Doi = {ARTN 234104},
404     Journal = jcp,
405     Publisher = {AMER INST PHYSICS},
406     Timescited = {15},
407     Title = {Is the {E}wald summation still necessary? Pairwise alternatives to the accepted standard for long-range electrostatics},
408     Volume = {124},
409     Year = {2006},
410     Bdsk-Url-1 = {http://dx.doi.org/234104}}
411    
412 jmarr 4025 @article{PhysRevLett.111.227801,
413     Author = {Whitmer, Jonathan K. and Wang, Xiaoguang and Mondiot, Frederic and Miller, Daniel S. and Abbott, Nicholas L. and de Pablo, Juan J.},
414     Date-Added = {2014-02-06 20:01:25 +0000},
415     Date-Modified = {2014-02-06 20:01:25 +0000},
416     Doi = {10.1103/PhysRevLett.111.227801},
417     Issue = {22},
418     Journal = {Phys. Rev. Lett.},
419     Month = {Nov},
420     Numpages = {5},
421     Pages = {227801},
422     Publisher = {American Physical Society},
423     Title = {Nematic-Field-Driven Positioning of Particles in Liquid Crystal Droplets},
424     Url = {http://link.aps.org/doi/10.1103/PhysRevLett.111.227801},
425     Volume = {111},
426     Year = {2013},
427     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.111.227801},
428     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.111.227801}}
429    
430 jmarr 4024 @article{Oh:2008fk,
431     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.},
432     Author = {Oh, Kwang-Im and Choi, Jun-Ho and Lee, Joo-Hyun and Han, Jae-Beom and Lee, Hochan and Cho, Minhaeng},
433     Date-Added = {2014-02-06 18:11:52 +0000},
434     Date-Modified = {2014-02-06 18:11:52 +0000},
435     Doi = {10.1063/1.2904558},
436     Journal = {J Chem Phys},
437     Journal-Full = {The Journal of chemical physics},
438     Month = {Apr},
439     Number = {15},
440     Pages = {154504},
441     Pmid = {18433232},
442     Pst = {ppublish},
443     Title = {Nitrile and thiocyanate IR probes: molecular dynamics simulation studies},
444     Volume = {128},
445     Year = {2008},
446     Bdsk-File-1 = {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}}
447    
448 gezelter 4007 @article{Gray:1973ca,
449     Author = {Gray, G.W. and Harrison, K.J. and Nash, J.A.},
450     Date-Added = {2014-01-20 19:18:33 +0000},
451     Date-Modified = {2014-01-20 19:18:35 +0000},
452     Doi = {10.1049/el:19730096},
453     Issn = {0013-5194},
454     Journal = {Electronics Letters},
455     Keywords = {display systems;electro-optical effects;liquid crystals;displays;nematic liquid crystals;positive dielectric anisotropy},
456     Number = {6},
457     Pages = {130-131},
458     Title = {New family of nematic liquid crystals for displays},
459     Volume = {9},
460     Year = {1973},
461     Bdsk-Url-1 = {http://dx.doi.org/10.1049/el:19730096}}
462    
463     @article{Lee:2006qd,
464     Author = {Lee, Lay Min and Kwon, Hye J. and Kang, Joo H. and Nuzzo, Ralph G. and Schweizer, Kenneth S.},
465     Date-Added = {2014-01-20 19:14:33 +0000},
466     Date-Modified = {2014-01-20 19:39:28 +0000},
467     Doi = {http://dx.doi.org/10.1063/1.2210930},
468     Eid = 024705,
469     Journal = {The Journal of Chemical Physics},
470     Number = {2},
471     Pages = {024705},
472     Title = {Anchoring and electro-optical dynamics of thin liquid crystalline films in a polyimide cell: Experiment and theory},
473     Url = {http://scitation.aip.org/content/aip/journal/jcp/125/2/10.1063/1.2210930},
474     Volume = {125},
475     Year = {2006},
476     Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/125/2/10.1063/1.2210930},
477     Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.2210930}}
478    
479     @article{Zhang:2011hh,
480     Author = {Zhang, Jianguo and Su, Jiaye and Guo, Hongxia},
481     Date-Added = {2014-01-20 19:13:11 +0000},
482     Date-Modified = {2014-01-20 19:39:44 +0000},
483     Doi = {10.1021/jp111408n},
484     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp111408n},
485     Journal = {The Journal of Physical Chemistry B},
486     Number = {10},
487     Pages = {2214-2227},
488     Title = {An Atomistic Simulation for 4-Cyano-4$^\prime$-pentylbiphenyl and Its Homologue with a Reoptimized Force Field},
489     Url = {http://pubs.acs.org/doi/abs/10.1021/jp111408n},
490     Volume = {115},
491     Year = {2011},
492     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp111408n},
493     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp111408n}}
494    
495     @article{Lim:2006xq,
496     Author = {Jong Kuk Lim and Ohyun Kwon and Dae Seung Kang and Sang-Woo Joo},
497     Date-Added = {2014-01-20 19:11:44 +0000},
498     Date-Modified = {2014-01-20 19:38:40 +0000},
499     Doi = {http://dx.doi.org/10.1016/j.cplett.2006.03.055},
500     Issn = {0009-2614},
501     Journal = {Chemical Physics Letters},
502     Number = {1--3},
503     Pages = {178 - 182},
504     Title = {Raman spectroscopy study and density functional theory calculations of the nematic liquid crystal 4-n-pentyl-4$^\prime$-cyanobiphenyl under an electric field},
505     Url = {http://www.sciencedirect.com/science/article/pii/S0009261406003873},
506     Volume = {423},
507     Year = {2006},
508     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/S0009261406003873},
509     Bdsk-Url-2 = {http://dx.doi.org/10.1016/j.cplett.2006.03.055}}
510    
511     @article{Tucker:2004qq,
512     Author = {Tucker, Matthew J. and Getahun, Zelleka and Nanda, Vikas and DeGrado, William F. and Gai, Feng},
513     Date-Added = {2014-01-20 19:10:42 +0000},
514     Date-Modified = {2014-01-20 19:10:45 +0000},
515     Doi = {10.1021/ja032015d},
516     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/ja032015d},
517     Journal = {Journal of the American Chemical Society},
518     Number = {16},
519     Pages = {5078-5079},
520     Title = {A New Method for Determining the Local Environment and Orientation of Individual Side Chains of Membrane-Binding Peptides},
521     Url = {http://pubs.acs.org/doi/abs/10.1021/ja032015d},
522     Volume = {126},
523     Year = {2004},
524     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/ja032015d},
525     Bdsk-Url-2 = {http://dx.doi.org/10.1021/ja032015d}}
526    
527     @article{Webb:2008kn,
528     Author = {Webb, Lauren J. and Boxer, Steven G.},
529     Date-Added = {2014-01-20 19:09:37 +0000},
530     Date-Modified = {2014-01-20 19:38:19 +0000},
531     Doi = {10.1021/bi701708u},
532     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/bi701708u},
533     Journal = {Biochemistry},
534     Note = {PMID: 18205401},
535     Number = {6},
536     Pages = {1588-1598},
537     Title = {Electrostatic Fields Near the Active Site of Human Aldose Reductase: 1. New Inhibitors and Vibrational Stark Effect Measurements},
538     Url = {http://pubs.acs.org/doi/abs/10.1021/bi701708u},
539     Volume = {47},
540     Year = {2008},
541     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/bi701708u},
542     Bdsk-Url-2 = {http://dx.doi.org/10.1021/bi701708u}}
543    
544     @article{Boxer:2009xw,
545     Author = {Boxer, Steven G.},
546     Date-Added = {2014-01-20 19:07:47 +0000},
547     Date-Modified = {2014-01-20 19:37:48 +0000},
548     Doi = {10.1021/jp8067393},
549     Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp8067393},
550     Journal = {The Journal of Physical Chemistry B},
551     Number = {10},
552     Pages = {2972-2983},
553     Title = {Stark Realities},
554     Url = {http://pubs.acs.org/doi/abs/10.1021/jp8067393},
555     Volume = {113},
556     Year = {2009},
557     Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp8067393},
558     Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp8067393}}
559    
560     @article{Hatta:1991ee,
561     Author = {A. Hatta and H. Amano and W. Su{\"e}taka},
562     Date-Added = {2014-01-20 19:05:00 +0000},
563     Date-Modified = {2014-01-20 19:05:03 +0000},
564     Doi = {http://dx.doi.org/10.1016/0924-2031(91)80006-A},
565     Issn = {0924-2031},
566     Journal = {Vibrational Spectroscopy},
567     Keywords = {Liquid crystals},
568     Number = {4},
569     Pages = {371 - 376},
570     Title = {Electric field response of 5CB liquid crystal molecules in the electrode boundary region as probed by modulation infrared \{ATR\} spectroscopy},
571     Url = {http://www.sciencedirect.com/science/article/pii/092420319180006A},
572     Volume = {1},
573     Year = {1991},
574     Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/092420319180006A},
575     Bdsk-Url-2 = {http://dx.doi.org/10.1016/0924-2031(91)80006-A}}
576    
577     @incollection{Prost:1980wt,
578     Author = {Prost, J.},
579     Booktitle = {Liquid Crystals of One- and Two-Dimensional Order},
580     Date-Added = {2014-01-20 19:01:37 +0000},
581     Date-Modified = {2014-01-20 19:01:41 +0000},
582     Doi = {10.1007/978-3-642-67848-6_29},
583     Editor = {Helfrich, W. and Heppke, G.},
584     Isbn = {978-3-642-67850-9},
585     Language = {English},
586     Pages = {125-145},
587     Publisher = {Springer Berlin Heidelberg},
588     Series = {Springer Series in Chemical Physics},
589     Title = {Reflections on the Reentrant Nematic and the SA-SA Phase Transitions},
590     Url = {http://dx.doi.org/10.1007/978-3-642-67848-6_29},
591     Volume = {11},
592     Year = {1980},
593     Bdsk-Url-1 = {http://dx.doi.org/10.1007/978-3-642-67848-6_29}}
594    
595     @article{HARDOUIN:1983qf,
596     Author = {HARDOUIN, F and LEVELUT, AM and ACHARD, MF and SIGAUD, G},
597     Date-Added = {2014-01-20 18:56:21 +0000},
598     Date-Modified = {2014-01-20 18:56:21 +0000},
599     Issn = {{0021-7689}},
600     Journal = {{JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE}},
601     Number = {{1}},
602     Pages = {{53-64}},
603     Title = {{POLYMORPHISM IN POLAR MESOGENS .1. PHYSICO-CHEMISTRY AND STRUCTURAL ASPECTS}},
604     Unique-Id = {{ISI:A1983QJ60700008}},
605     Volume = {{80}},
606     Year = {{1983}}}
607    
608     @article{Leadbetter:1976vf,
609     Author = {Leadbetter, A. J. and Durrant, J. L. A. and Rugman, M.},
610     Date-Added = {2014-01-20 18:54:50 +0000},
611     Date-Modified = {2014-01-20 18:54:54 +0000},
612     Doi = {10.1080/15421407708083712},
613     Eprint = {http://www.tandfonline.com/doi/pdf/10.1080/15421407708083712},
614     Journal = {Molecular Crystals and Liquid Crystals},
615     Number = {10},
616     Pages = {231-235},
617     Title = {The Density Of 4 n-Octyl-4-Cyano-Biphenyl (8CB)},
618     Url = {http://www.tandfonline.com/doi/abs/10.1080/15421407708083712},
619     Volume = {34},
620     Year = {1976},
621     Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/15421407708083712},
622     Bdsk-Url-2 = {http://dx.doi.org/10.1080/15421407708083712}}
623    
624     @book{Gray:1984hc,
625     Author = {Gray, G.W. and Goodby, J.W.G.},
626     Date-Added = {2014-01-20 18:39:08 +0000},
627     Date-Modified = {2014-01-20 18:39:08 +0000},
628     Isbn = {9780249441680},
629     Lccn = {lc84164554},
630     Publisher = {L. Hill},
631     Title = {Smectic liquid crystals: textures and structures},
632     Url = {http://books.google.com/books?id=WgTwAAAAMAAJ},
633     Year = {1984},
634     Bdsk-Url-1 = {http://books.google.com/books?id=WgTwAAAAMAAJ}}
635    
636     @article{Vanakaras:1998it,
637     Author = {Vanakaras, Alexandros G. and Photinos, Demetri J. and Samulski, Edward T.},
638     Date-Added = {2014-01-20 18:37:13 +0000},
639     Date-Modified = {2014-01-20 18:37:15 +0000},
640     Doi = {10.1103/PhysRevE.57.R4875},
641     Issue = {5},
642     Journal = {Phys. Rev. E},
643     Month = {May},
644     Numpages = {0},
645     Pages = {R4875--R4878},
646     Publisher = {American Physical Society},
647     Title = {Tilt, polarity, and spontaneous symmetry breaking in liquid crystals},
648     Url = {http://link.aps.org/doi/10.1103/PhysRevE.57.R4875},
649     Volume = {57},
650     Year = {1998},
651     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.57.R4875},
652     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.57.R4875}}
653    
654     @article{Prost:1984qe,
655     Author = {Prost, J.},
656     Date-Added = {2014-01-20 18:36:25 +0000},
657     Date-Modified = {2014-01-20 18:36:29 +0000},
658     Doi = {10.1080/00018738400101631},
659     Eprint = {http://www.tandfonline.com/doi/pdf/10.1080/00018738400101631},
660     Journal = {Advances in Physics},
661     Number = {1},
662     Pages = {1-46},
663     Title = {The smectic state},
664     Url = {http://www.tandfonline.com/doi/abs/10.1080/00018738400101631},
665     Volume = {33},
666     Year = {1984},
667     Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/00018738400101631},
668     Bdsk-Url-2 = {http://dx.doi.org/10.1080/00018738400101631}}
669    
670     @article{Photinos:1976xe,
671     Author = {Photinos, Panagoitis J. and Saupe, Alfred},
672     Date-Added = {2014-01-20 18:34:10 +0000},
673     Date-Modified = {2014-01-20 18:34:14 +0000},
674     Doi = {10.1103/PhysRevA.13.1926},
675     Issue = {5},
676     Journal = {Phys. Rev. A},
677     Month = {May},
678     Numpages = {0},
679     Pages = {1926--1930},
680     Publisher = {American Physical Society},
681     Title = {Mean-field study of uniaxial smectic liquid crystals with polarized layers},
682     Url = {http://link.aps.org/doi/10.1103/PhysRevA.13.1926},
683     Volume = {13},
684     Year = {1976},
685     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.13.1926},
686     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.13.1926}}
687    
688     @article{Netz:1992cr,
689     Author = {Netz, Roland R. and Berker, A. Nihat},
690     Date-Added = {2014-01-20 18:33:40 +0000},
691     Date-Modified = {2014-01-20 18:33:43 +0000},
692     Doi = {10.1103/PhysRevLett.68.333},
693     Issue = {3},
694     Journal = {Phys. Rev. Lett.},
695     Month = {Jan},
696     Numpages = {0},
697     Pages = {333--336},
698     Publisher = {American Physical Society},
699     Title = {Smectic-<i>C</i> order, in-plane domains, and nematic reentrance in a microscopic model of liquid crystals},
700     Url = {http://link.aps.org/doi/10.1103/PhysRevLett.68.333},
701     Volume = {68},
702     Year = {1992},
703     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevLett.68.333},
704     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevLett.68.333}}
705    
706     @article{Meyer:1976qd,
707     Author = {Meyer, Robert B. and Lubensky, T. C.},
708     Date-Added = {2014-01-20 18:33:13 +0000},
709     Date-Modified = {2014-01-20 19:12:04 +0000},
710     Doi = {10.1103/PhysRevA.14.2307},
711     Issue = {6},
712     Journal = {Phys. Rev. A},
713     Month = {Dec},
714     Numpages = {0},
715     Pages = {2307--2320},
716     Publisher = {American Physical Society},
717     Title = {Mean-field theory of the nematic-smectic-A phase change in liquid crystals},
718     Url = {http://link.aps.org/doi/10.1103/PhysRevA.14.2307},
719     Volume = {14},
720     Year = {1976},
721     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.14.2307},
722     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.14.2307}}
723    
724     @article{Levesque:1993pd,
725     Author = {Levesque, D. and Weis, J. J. and Zarragoicoechea, G. J.},
726     Date-Added = {2014-01-20 18:32:43 +0000},
727     Date-Modified = {2014-01-20 18:32:45 +0000},
728     Doi = {10.1103/PhysRevE.47.496},
729     Issue = {1},
730     Journal = {Phys. Rev. E},
731     Month = {Jan},
732     Numpages = {0},
733     Pages = {496--505},
734     Publisher = {American Physical Society},
735     Title = {Monte Carlo simulation study of mesophase formation in dipolar spherocylinders},
736     Url = {http://link.aps.org/doi/10.1103/PhysRevE.47.496},
737     Volume = {47},
738     Year = {1993},
739     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevE.47.496},
740     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevE.47.496}}
741    
742     @article{Levelut:1981eu,
743     Author = {Levelut, A. M. and Tarento, R. J. and Hardouin, F. and Achard, M. F. and Sigaud, G.},
744     Date-Added = {2014-01-20 18:32:07 +0000},
745     Date-Modified = {2014-01-20 18:49:25 +0000},
746     Doi = {10.1103/PhysRevA.24.2180},
747     Issue = {4},
748     Journal = {Phys. Rev. A},
749     Month = {Oct},
750     Numpages = {0},
751     Pages = {2180--2186},
752     Publisher = {American Physical Society},
753     Title = {Number of SA phases},
754     Url = {http://link.aps.org/doi/10.1103/PhysRevA.24.2180},
755     Volume = {24},
756     Year = {1981},
757     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.24.2180},
758     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.24.2180}}
759    
760     @article{Jeu:1983ly,
761     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.},
762     Author = {Jeu, W. H. De and Raynes, E. P. and Price, A. H. and Clark, M. G.},
763     Date-Added = {2014-01-20 18:30:36 +0000},
764     Date-Modified = {2014-01-20 18:30:39 +0000},
765     Doi = {10.1098/rsta.1983.0035},
766     Eprint = {http://rsta.royalsocietypublishing.org/content/309/1507/217.full.pdf+html},
767     Journal = {Philosophical Transactions of the Royal Society of London. Series A, Mathematical and Physical Sciences},
768     Number = {1507},
769     Pages = {217-229},
770     Title = {Liquid Crystalline Materials: Physical Properties and Intermolecular Interactions [and Discussion]},
771     Url = {http://rsta.royalsocietypublishing.org/content/309/1507/217.abstract},
772     Volume = {309},
773     Year = {1983},
774     Bdsk-Url-1 = {http://rsta.royalsocietypublishing.org/content/309/1507/217.abstract},
775     Bdsk-Url-2 = {http://dx.doi.org/10.1098/rsta.1983.0035}}
776    
777     @article{Indekeu:1986ty,
778     Author = {Indekeu, J. O. and Berker, A. Nihat},
779     Date-Added = {2014-01-20 18:27:51 +0000},
780     Date-Modified = {2014-01-20 18:50:31 +0000},
781     Doi = {10.1103/PhysRevA.33.1158},
782     Issue = {2},
783     Journal = {Phys. Rev. A},
784     Month = {Feb},
785     Numpages = {0},
786     Pages = {1158--1162},
787     Publisher = {American Physical Society},
788     Title = {Quadruple reentrance (nematic-smectic-Ad-nematic-smectic-Ad-nematic-smectic-A1) from the frustrated spin-gas model of liquid crystals},
789     Url = {http://link.aps.org/doi/10.1103/PhysRevA.33.1158},
790     Volume = {33},
791     Year = {1986},
792     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.33.1158},
793     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.33.1158}}
794    
795     @incollection{Hardouin:1980yq,
796     Author = {Hardouin, F. and Levelut, A.M. and Benattar, J.J. and Sigaud, G.},
797     Booktitle = {Liquid Crystals of One- and Two-Dimensional Order},
798     Date-Added = {2014-01-20 18:26:57 +0000},
799     Date-Modified = {2014-01-20 18:26:59 +0000},
800     Doi = {10.1007/978-3-642-67848-6_31},
801     Editor = {Helfrich, W. and Heppke, G.},
802     Isbn = {978-3-642-67850-9},
803     Language = {English},
804     Pages = {147-147},
805     Publisher = {Springer Berlin Heidelberg},
806     Series = {Springer Series in Chemical Physics},
807     Title = {X-Ray Investigations of the Smectic A1 --- Smectic A2 Transition},
808     Url = {http://dx.doi.org/10.1007/978-3-642-67848-6_31},
809     Volume = {11},
810     Year = {1980},
811     Bdsk-Url-1 = {http://dx.doi.org/10.1007/978-3-642-67848-6_31}}
812    
813     @article{Dowell:1985qf,
814     Author = {Dowell, F.},
815     Date-Added = {2014-01-20 18:25:24 +0000},
816     Date-Modified = {2014-01-20 18:25:26 +0000},
817     Doi = {10.1103/PhysRevA.31.3214},
818     Issue = {5},
819     Journal = {Phys. Rev. A},
820     Month = {May},
821     Numpages = {0},
822     Pages = {3214--3219},
823     Publisher = {American Physical Society},
824     Title = {Effect of longitudinal dipoles in liquid crystals},
825     Url = {http://link.aps.org/doi/10.1103/PhysRevA.31.3214},
826     Volume = {31},
827     Year = {1985},
828     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.31.3214},
829     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.31.3214}}
830    
831     @article{Baus:1989fk,
832     Author = {Baus, Marc and Colot, Jean-Louis},
833     Date-Added = {2014-01-20 18:24:36 +0000},
834     Date-Modified = {2014-01-20 18:24:39 +0000},
835     Doi = {10.1103/PhysRevA.40.5444},
836     Issue = {9},
837     Journal = {Phys. Rev. A},
838     Month = {Nov},
839     Numpages = {0},
840     Pages = {5444--5446},
841     Publisher = {American Physical Society},
842     Title = {Ferroelectric nematic liquid-crystal phases of dipolar hard ellipsoids},
843     Url = {http://link.aps.org/doi/10.1103/PhysRevA.40.5444},
844     Volume = {40},
845     Year = {1989},
846     Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevA.40.5444},
847     Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevA.40.5444}}