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McKinnon, Joshua J., Spackman, Mark A., Mitchell, Anthony S. (2004) Novel tools for visualizing and exploring intermolecular interactions in molecular crystals. Acta Crystallographica Section B Structural Science, 60 (6) 627-668 doi:10.1107/s0108768104020300

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Reference TypeJournal (article/letter/editorial)
TitleNovel tools for visualizing and exploring intermolecular interactions in molecular crystals
JournalActa Crystallographica Section B Structural Science
AuthorsMcKinnon, Joshua J.Author
Spackman, Mark A.Author
Mitchell, Anthony S.Author
Year2004 (December 1)Volume60
Issue6
PublisherInternational Union of Crystallography (IUCr)
DOIdoi:10.1107/s0108768104020300Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID188085Long-form Identifiermindat:1:5:188085:8
GUID0
Full ReferenceMcKinnon, Joshua J., Spackman, Mark A., Mitchell, Anthony S. (2004) Novel tools for visualizing and exploring intermolecular interactions in molecular crystals. Acta Crystallographica Section B Structural Science, 60 (6) 627-668 doi:10.1107/s0108768104020300
Plain TextMcKinnon, Joshua J., Spackman, Mark A., Mitchell, Anthony S. (2004) Novel tools for visualizing and exploring intermolecular interactions in molecular crystals. Acta Crystallographica Section B Structural Science, 60 (6) 627-668 doi:10.1107/s0108768104020300
In(2004, December) Acta Crystallographica Section B Structural Science Vol. 60 (6) International Union of Crystallography (IUCr)

See Also

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Spackman, Mark A., McKinnon, Joshua J. (2002) Fingerprinting intermolecular interactions in molecular crystals. CrystEngComm, 4. 378-392 doi:10.1039/b203191b
Jayatilaka, D., Wolff, S. K., Grimwood, D. J., McKinnon, J. J., Spackman, M. A. (2006) CrystalExplorer: a tool for displaying Hirshfeld surfaces and visualising intermolecular interactions in molecular crystals. Acta Crystallographica Section A Foundations of Crystallography, 62. doi:10.1107/s0108767306098199
McKinnon, Joshua J., Mitchell, Anthony S., Spackman, Mark A. (1998) Hirshfeld Surfaces: A New Tool for Visualising and Exploring Molecular Crystals. Chemistry - A European Journal, 4 (11). 2136-2141 doi:10.1002/(sici)1521-3765(19981102)4:11<2136::aid-chem2136>3.0.co;2-g
Spackman, M. A., Meng, X., McKinnon, J. J., Mitchell, A. S. (2002) Hirshfeld surfaces in molecular and ionic crystals: applications to crystal engineering and comparisons with Bader's atomic and molecular volumes. Acta Crystallographica Section A Foundations of Crystallography, 58. doi:10.1107/s0108767302086592
Beake, Edward, Dove, Martin, Phillips, Anthony (2014) Intermolecular interactions in molecular crystals and glasses. Acta Crystallographica Section A Foundations and Advances, 70. doi:10.1107/s2053273314091372
Esterhuysen, C., Cronje, S., Raubenheimer, H. G., Kruger, G. J. (2004) Intermolecular interactions in AuIand AuIIIcomplexes. Acta Crystallographica Section A Foundations of Crystallography, 60. doi:10.1107/s0108767304097843
Turner, Michael J., Grabowsky, Simon, Jayatilaka, Dylan, Spackman, Mark A. (2014) Accurate and Efficient Model Energies for Exploring Intermolecular Interactions in Molecular Crystals. The Journal of Physical Chemistry Letters, 5 (24). 4249-4255 doi:10.1021/jz502271c
Eikeland, Espen, Madsen, Solveig, Overgaard, Jacob, Spackman, Mark, Iversen, Bo (2014) Exploring Host-Guest Interactions: a Single Crystal High-Pressure study. Acta Crystallographica Section A Foundations and Advances, 70. doi:10.1107/s2053273314092432
Spackman, M.A., McKinnon, J.J., Jayatilaka, D. (2008) Electrostatic complementarity: a universal theme in molecular crystal structures?. Acta Crystallographica Section A Foundations of Crystallography, 64. doi:10.1107/s0108767308097353
Whitten, Andrew E., Spackman, Mark A. (2006) Anisotropic displacement parameters for H atoms using an ONIOM approach. Acta Crystallographica Section B Structural Science, 62 (5) 875-888 doi:10.1107/s0108768106020787
Filippini, G., Gavezzotti, A. (1993) Empirical intermolecular potentials for organic crystals: the `6-exp' approximation revisited. Acta Crystallographica Section B Structural Science, 49 (5) 868-880 doi:10.1107/s0108768193002150
 
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