J. Grant Hill

Affiliations: 
School of Chemistry University of Glasgow, Glasgow, Scotland, United Kingdom 
 2014- University of Sheffield, Sheffield, England, United Kingdom 
Area:
Theoretical chemistry, computational chemistry
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"J. Grant Hill"
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Publications

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Nash HW, Shaw RA, Hill JG. (2023) Correlation consistent auxiliary basis sets in density fitting Hartree-Fock: The atoms sodium through argon revisited. Journal of Computational Chemistry
Hill JG, Peterson KA. (2017) Gaussian basis sets for use in correlated molecular calculations. XI. Pseudopotential-based and all-electron relativistic basis sets for alkali metal (K-Fr) and alkaline earth (Ca-Ra) elements. The Journal of Chemical Physics. 147: 244106
Vasiliu M, Hill JG, Peterson KA, et al. (2017) Structures and Heats of Formation of Simple Alkaline Earth Metal Compounds II: Fluorides, Chlorides, Oxides, and Hydroxides for Ba, Sr, and Ra. The Journal of Physical Chemistry. A
Sun Z, Moore KB, Hill JG, et al. (2017) Alkali Metal Trihalides: M+X3- Ion Pair or MX-X2 Complex? The Journal of Physical Chemistry. B
Shaw RA, Hill JG. (2017) Approaching the Hartree-Fock Limit Through the CABS Singles Correction and Auxiliary Basis Sets. Journal of Chemical Theory and Computation
Hill JG, Legon AC. (2015) On the directionality and non-linearity of halogen and hydrogen bonds. Physical Chemistry Chemical Physics : Pccp. 17: 858-67
Hill JG, Peterson KA. (2014) Correlation consistent basis sets for explicitly correlated wavefunctions: pseudopotential-based basis sets for the post-d main group elements Ga-Rn. The Journal of Chemical Physics. 141: 094106
Hill JG, Das A. (2014) Interaction in the indole···imidazole heterodimer: structure, Franck-Condon analysis and energy decomposition. Physical Chemistry Chemical Physics : Pccp. 16: 11754-62
Platts JA, Hill JG, Riley KE, et al. (2013) Basis Set Dependence of Interaction Energies Computed Using Composite Post-MP2 Methods. Journal of Chemical Theory and Computation. 9: 330-7
Bross DH, Hill JG, Werner HJ, et al. (2013) Explicitly correlated composite thermochemistry of transition metal species. The Journal of Chemical Physics. 139: 094302
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