Hydrogen bonding and molecular orientation at the liquid-vapour interface of water

Physical Chemistry Chemical Physics

Volumn 17, Issue 14, 2015, Pages 8660-8669

  Cipcigan, Flaviu S ^a   Sokhan, Vlad P ^b   Jones, Andrew P ^a,b   Crain, Jason ^a,b   Martyna, Glenn J ^a,c  

^a UNIVERSITY OF EDINBURGH   (United Kingdom)

^b NATIONAL PHYSICAL LABORATORY   (United Kingdom)

^c IBM T J WATSON RESEARCH CENTER   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84993661490     PISSN: 14639076     EISSN: None     Source Type: Journal    
DOI: 10.1039/c4cp05506c     Document Type: Article

References (38)

1. F. Stillinger J. Solution Chem. 1973 2 141 158
2. A. P. Willard D. Chandler J. Chem. Phys. 2014 141 18C519
3. Q. Du R. Superfine E. Freysz Y. Shen Phys. Rev. Lett. 1993 70 2313 2316
4. E. A. Raymond T. L. Tarbuck M. G. Brown G. L. Richmond J. Phys. Chem. B 2003 107 546 556
5. B. M. Auer J. L. Skinner J. Chem. Phys. 2008 129 214705
6. P. A. Pieniazek C. J. Tainter J. L. Skinner J. Am. Chem. Soc. 2011 133 10360 10363
7. S. Nihonyanagi J. A. Mondal S. Yamaguchi T. Tahara Annu. Rev. Phys. Chem. 2013 64 579 603
8. C.-S. Hsieh M. Okuno J. Hunger E. H. G. Backus Y. Nagata M. Bonn Angew. Chem., Int. Ed. 2014 53 8146 8149
9. C.-S. Hsieh R. K. Campen M. Okuno E. H. G. Backus Y. Nagata M. Bonn Proc. Natl. Acad. Sci. U. S. A. 2013 110 18780 18785
10. D. Marx Science 2004 303 634 636
11. M. A. Wilson A. Pohorille L. R. Pratt J. Phys. Chem. 1987 91 4873 4878
12. I.-F. W. Kuo Science 2004 303 658 660
13. T. D. Kühne T. A. Pascal E. Kaxiras Y. Jung J. Phys. Chem. Lett. 2011 2 105 113
14. I.-F. W. Kuo C. J. Mundy B. L. Eggimann M. J. McGrath J. I. Siepmann B. Chen J. Vieceli D. J. Tobias J. Phys. Chem. B 2006 110 3738 3746
15. C. D. Wick I.-F. W. Kuo C. J. Mundy L. X. Dang J. Chem. Theory Comput. 2007 3 2002 2010
16. C. Vega E. de Miguel J. Chem. Phys. 2007 126 154707
17. Y. A. Mantz B. Chen G. J. Martyna Chem. Phys. Lett. 2005 405 294 299
18. I.-C. Lin A. P. Seitsonen I. Tavernelli U. Rothlisberger J. Chem. Theory Comput. 2012 8 3902 3910
19. A. Jones F. Cipcigan V. P. Sokhan J. Crain G. J. Martyna Phys. Rev. Lett. 2013 110 227801
20. V. Sokhan, A. Jones, F. Cipcigan, J. Crain and G. Martyna, Signature properties of water: Their molecular electronic origins, in preparation
21. A. Jones J. Crain F. Cipcigan V. Sokhan M. Modani G. Martyna Mol. Phys. 2013 111 3465 3477
22. R. Kumar J. R. Schmidt J. L. Skinner J. Chem. Phys. 2007 126 204107
23. A. Jones, PhD thesis, The University of Edinburgh, 2010
24. G. J. Martyna M. L. Klein M. Tuckerman J. Chem. Phys. 1992 97 2635
25. E. Lemmon, M. McLinden and D. Friend, Thermophysical Properties of Fluid Systems, NIST Standard Reference Database Number 69, National Institute of Standards and Technology, 2005
26. A. K. Soper ISRN Phys. Chem. 2013 1 67
27. C. A. Coulson D. Eisenberg Proc. R. Soc. A 1966 291 445 453
28. Y. S. Badyal M.-L. Saboungi D. L. Price S. D. Shastri D. R. Haeffner A. K. Soper J. Chem. Phys. 2000 112 9206
29. P. Silvestrelli M. Parrinello Phys. Rev. Lett. 1999 82 3308 3311
30. W. Wagner J. Phys. Chem. Ref. Data 1999 31 387
31. P. Holoborodko, Smooth Noise Robust Differentiators,bit.ly/noise-differentiators, 2008
32. K. R. Wilson R. D. Schaller D. T. Co R. J. Saykally B. S. Rude T. Catalano J. D. Bozek J. Chem. Phys. 2002 117 7738
33. L. Pauling, The Nature of the Chemical Bond and the Structure of Molecules and Crystals: An Introduction to Modern Structural Chemistry, Cornell University Press, 1960
34. A. P. Willard D. Chandler J. Phys. Chem. B 2010 114 1954 1958
35. P. Wernet Science 2004 304 995 999
36. T. Head-Gordon M. E. Johnson Proc. Natl. Acad. Sci. U. S. A. 2006 103 7973 7977
37. T. D. Kühne R. Z. Khaliullin Nat. Commun. 2013 4 1450
38. T. D. Kühne R. Z. Khaliullin J. Am. Chem. Soc. 2014 136 3395 3399