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The microscopic features of heterogeneous ice nucleation may affect the macroscopic morphology of atmospheric ice crystals.
Cox SJ, Raza Z, Kathmann SM, Slater B, Michaelides A. Cox SJ, et al. Among authors: slater b. Faraday Discuss. 2013;167:389-403. doi: 10.1039/c3fd00059a. Faraday Discuss. 2013. PMID: 24640502
Surface energy and surface proton order of the ice Ih basal and prism surfaces.
Pan D, Liu LM, Tribello GA, Slater B, Michaelides A, Wang E. Pan D, et al. Among authors: slater b. J Phys Condens Matter. 2010 Feb 24;22(7):074209. doi: 10.1088/0953-8984/22/7/074209. Epub 2010 Feb 3. J Phys Condens Matter. 2010. PMID: 21386387
Hydrogen bonds and van der waals forces in ice at ambient and high pressures.
Santra B, Klimeš J, Alfè D, Tkatchenko A, Slater B, Michaelides A, Car R, Scheffler M. Santra B, et al. Among authors: slater b. Phys Rev Lett. 2011 Oct 28;107(18):185701. doi: 10.1103/PhysRevLett.107.185701. Epub 2011 Oct 25. Phys Rev Lett. 2011. PMID: 22107644
Melting the ice: on the relation between melting temperature and size for nanoscale ice crystals.
Pan D, Liu LM, Slater B, Michaelides A, Wang E. Pan D, et al. Among authors: slater b. ACS Nano. 2011 Jun 28;5(6):4562-9. doi: 10.1021/nn200252w. Epub 2011 May 20. ACS Nano. 2011. PMID: 21568289
Surface energy and surface proton order of ice Ih.
Pan D, Liu LM, Tribello GA, Slater B, Michaelides A, Wang E. Pan D, et al. Among authors: slater b. Phys Rev Lett. 2008 Oct 10;101(15):155703. doi: 10.1103/PhysRevLett.101.155703. Epub 2008 Oct 9. Phys Rev Lett. 2008. PMID: 18999613
Communication: On the stability of ice 0, ice i, and I(h).
Quigley D, Alfè D, Slater B. Quigley D, et al. Among authors: slater b. J Chem Phys. 2014 Oct 28;141(16):161102. doi: 10.1063/1.4900772. J Chem Phys. 2014. PMID: 25362263
Molecular simulations of heterogeneous ice nucleation. I. Controlling ice nucleation through surface hydrophilicity.
Cox SJ, Kathmann SM, Slater B, Michaelides A. Cox SJ, et al. Among authors: slater b. J Chem Phys. 2015 May 14;142(18):184704. doi: 10.1063/1.4919714. J Chem Phys. 2015. PMID: 25978902
The phase diagram of water at negative pressures: virtual ices.
Conde MM, Vega C, Tribello GA, Slater B. Conde MM, et al. Among authors: slater b. J Chem Phys. 2009 Jul 21;131(3):034510. doi: 10.1063/1.3182727. J Chem Phys. 2009. PMID: 19624212
On the accuracy of van der Waals inclusive density-functional theory exchange-correlation functionals for ice at ambient and high pressures.
Santra B, Klimes J, Tkatchenko A, Alfè D, Slater B, Michaelides A, Car R, Scheffler M. Santra B, et al. Among authors: slater b. J Chem Phys. 2013 Oct 21;139(15):154702. doi: 10.1063/1.4824481. J Chem Phys. 2013. PMID: 24160528
Here, we report a detailed study with several xc functionals (semi-local, hybrid, and vdW inclusive approaches) on ice Ih and six proton ordered phases of ice. Consistent with our previous study [B. Santra, J. Klimes, D. Alfe, A. Tkatchenko, B. Slater, A. Mic …
Here, we report a detailed study with several xc functionals (semi-local, hybrid, and vdW inclusive approaches) on ice Ih and six proton ord …
Bubbles and microporous frameworks of silicon carbide.
Watkins MB, Shevlin SA, Sokol AA, Slater B, Catlow CR, Woodley SM. Watkins MB, et al. Among authors: slater b. Phys Chem Chem Phys. 2009 May 7;11(17):3186-200. doi: 10.1039/b902603g. Epub 2009 Mar 27. Phys Chem Chem Phys. 2009. PMID: 19370214
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