Mark Spackman
Mark Spackman
Professor of Chemistry, University of Western Australia
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Cited by
Cited by
Hirshfeld surface analysis
MA Spackman, D Jayatilaka
CrystEngComm 11 (1), 19-32, 2009
Crystal explorer
SK Wolff, DJ Grimwood, JJ McKinnon, MJ Turner, D Jayatilaka, ...
University of Western Australia, 2012
Fingerprinting intermolecular interactions in molecular crystals
MA Spackman, JJ McKinnon
CrystEngComm 4 (66), 378-392, 2002
Novel tools for visualizing and exploring intermolecular interactions in molecular crystals
JJ McKinnon, MA Spackman, AS Mitchell
Acta Crystallographica Section B: Structural Science 60 (6), 627-668, 2004
MJ Turner, JJ McKinnon, SK Wolff, DJ Grimwood, PR Spackman, ...
The University of Western Australia, 2017
Towards quantitative analysis of intermolecular interactions with Hirshfeld surfaces
JJ McKinnon, D Jayatilaka, MA Spackman
Chemical Communications, 3814-3816, 2007
A novel definition of a molecule in a crystal
MA Spackman, PG Byrom
Chemical physics letters 267 (3-4), 215-220, 1997
Electrostatic potentials mapped on Hirshfeld surfaces provide direct insight into intermolecular interactions in crystals
MA Spackman, JJ McKinnon, D Jayatilaka
CrystEngComm 10 (4), 377-388, 2008
Hirshfeld surfaces: a new tool for visualising and exploring molecular crystals
JJ McKinnon, AS Mitchell, MA Spackman
Chemistry–A European Journal 4 (11), 2136-2141, 1998
CrystalExplorer model energies and energy frameworks: extension to metal coordination compounds, organic salts, solvates and open-shell systems
CF Mackenzie, PR Spackman, D Jayatilaka, MA Spackman
IUCrJ 4 (5), 575-587, 2017
Comparing entire crystal structures: structural genetic fingerprinting
A Parkin, G Barr, W Dong, CJ Gilmore, D Jayatilaka, JJ McKinnon, ...
CrystEngComm 9 (8), 648-652, 2007
Energy frameworks: insights into interaction anisotropy and the mechanical properties of molecular crystals
MJ Turner, SP Thomas, MW Shi, D Jayatilaka, MA Spackman
Chemical Communications 51 (18), 3735-3738, 2015
A simple quantitative model of hydrogen bonding
MA Spackman
The Journal of chemical physics 85 (11), 6587-6601, 1986
Accurate prediction of static dipole polarizabilities with moderately sized basis sets
MA Spackman
The Journal of Physical Chemistry 93 (22), 7594-7603, 1989
Visualisation and characterisation of voids in crystalline materials
MJ Turner, JJ McKinnon, D Jayatilaka, MA Spackman
CrystEngComm 13 (6), 1804-1813, 2011
Atom–atom potentials via electron gas theory
MA Spackman
The Journal of chemical physics 85 (11), 6579-6586, 1986
Accurate and efficient model energies for exploring intermolecular interactions in molecular crystals
MJ Turner, S Grabowsky, D Jayatilaka, MA Spackman
The journal of physical chemistry letters 5 (24), 4249-4255, 2014
Comparison of polymorphic molecular crystal structures through Hirshfeld surface analysis
JJ McKinnon, FPA Fabbiani, MA Spackman
Crystal growth & design 7 (4), 755-769, 2007
Three new co-crystals of hydroquinone: crystal structures and Hirshfeld surface analysis of intermolecular interactions
HF Clausen, MS Chevallier, MA Spackman, BB Iversen
New Journal of Chemistry 34 (2), 193-199, 2010
Molecular electric moments from X-ray diffraction data
MA Spackman
Chemical reviews 92 (8), 1769-1797, 1992
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