Mark A. Spackman
Affiliations: | 1987-2004 | University of New England, Biddeford, ME, United States | |
| 2004- | The University of Western Australa |
Area:
Computational chemistry, Crystal structure analysis, Crystallography, Theoretical chemistryWebsite:
https://research-repository.uwa.edu.au/en/persons/mark-spackmanGoogle:
"Mark Spackman"Cross-listing: Chemistry Tree
Parents
Sign in to add mentor| Graham S. Chandler | grad student | 1980 | The University of Western Australa (Chemistry Tree) | |
| (A theoretical examination of the pseudoatom expansion model for molecular electron densities.) | ||||
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Publications
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| Spackman PR, Spackman MA, Gale JD. (2023) A transferable quantum mechanical energy model for intermolecular interactions using a single empirical parameter. Iucrj. 10: 754-765 |
| Grabowsky S, Spackman MA. (2022) Structure correlation and dynamics in crystals - a tribute to Hans-Beat Bürgi. Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials. 78: 281-282 |
| Loedolff MJ, Fuller RO, Nealon GL, et al. (2022) Solution-phase decomposition of ferrocene into wüstite-iron oxide core-shell nanoparticles. Dalton Transactions (Cambridge, England : 2003) |
| Karothu DP, Halabi JM, Ahmed E, et al. (2021) Global Analysis of the Mechanical Properties of Organic Crystals. Angewandte Chemie (International Ed. in English) |
| Spackman PR, Grosjean A, Thomas SP, et al. (2021) Quantifying Mechanical Properties of Molecular Crystals: A Critical Overview of Experimental Elastic Tensors. Angewandte Chemie (International Ed. in English) |
| Spackman PR, Turner MJ, McKinnon JJ, et al. (2021) : a program for Hirshfeld surface analysis, visualization and quantitative analysis of molecular crystals. Journal of Applied Crystallography. 54: 1006-1011 |
| Spackman PR, Yu LJ, Morton CJ, et al. (2019) Bridging crystal engineering and drug discovery by utilizing intermolecular interactions and molecular shapes in crystals. Angewandte Chemie (International Ed. in English) |
| Thomas SP, Grosjean A, Flematti GR, et al. (2019) Investigation of an unusual crystal habit of hydrochlorothiazide reveals large polar enantiopure domains and a possible crystal nucleation mechanism. Angewandte Chemie (International Ed. in English) |
| Shi MW, Thomas SP, Hathwar VR, et al. (2019) Measurement of Electric Fields Experienced by Urea Guest Molecules in the 18-Crown-6:Urea (1:5) Host-Guest Complex: An Experimental Reference Point for Electric-Field-Assisted Catalysis. Journal of the American Chemical Society |
| Fugel M, Malaspina LA, Pal R, et al. (2019) Revisiting a historic concept using quantum crystallography: Are phosphate, sulfate and perchlorate anions hypervalent? Chemistry (Weinheim An Der Bergstrasse, Germany) |