Johnson, Erin R. - Dalhousie University

研究领域

Development and applications of density-functional theory for study of electronic structure. Current applications include non-covalent interactions, molecular crystals, layered solids, electrides, and organometallic complexes.

近期论文

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S. R. Whittleton, A. Otero de la Roza, E. R. Johnson, The exchange-hole dipole dispersion model for accurate energy ranking in molecular crystal structure prediction, J. Chem. Theory Comput. 13, 441-450 (2017). L. M. LeBlanc, A. Otero de la Roza, E. R. Johnson, Evaluation of shear-slip transitions in crystalline aspirin by density-functional theory, Cryst. Growth Des. 16, 6867-6873 (2016). S. G. Dale, E. R. Johnson, The explicit examination of the magnetic states of electrides, Phys. Chem. Chem. Phys. 18, 27326-27335 (2016). A. Otero de la Roza, J. E. Hein, E. R. Johnson, Reevaluating the stability and prevalence of conglomerates: Implications for preferential crystallization, Cryst. Growth Des. 16, 6055-6059 (2016). M. S. Christian, A. Otero de la Roza, E. R. Johnson, Surface adsorption from the exchange-hole dipole moment dispersion model, J. Chem. Theory Comput. 12, 3305-3315 (2016). A. Otero de la Roza, G. A. DiLabio, E. R. Johnson, Exchange-correlation effects for non-covalent interactions in density-functional theory, J. Chem. Theory Comput. 12, 3160-3175 (2016).