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Alastair J. A. Price
Alastair J. A. Price
Verified email at utoronto.ca
Title
Cited by
Cited by
Year
Measurement of absolute photoluminescence quantum yields using integrating spheres–Which way to go?
DO Faulkner, JJ McDowell, AJ Price, DD Perovic, NP Kherani, GA Ozin
Laser & Photonics Reviews 6 (6), 802-806, 2012
632012
Requirements for an accurate dispersion-corrected density functional
AJA Price, KR Bryenton, ER Johnson
The Journal of Chemical Physics 154 (23), 2021
512021
Pure blue emitting poly (3, 6-dimethoxy-9, 9-dialkylsilafluorenes) prepared via nickel-catalyzed cross-coupling of diarylmagnesate monomers
JJ McDowell, I Schick, A Price, D Faulkner, G Ozin
Macromolecules 46 (17), 6794-6805, 2013
212013
XDM-corrected hybrid DFT with numerical atomic orbitals predicts molecular crystal lattice energies with unprecedented accuracy
AJA Price, A Otero-de-la-Roza, ER Johnson
Chemical Science 14 (5), 1252-1262, 2023
192023
Theoretical investigation of amino-acid adsorption on hydroxylated quartz surfaces: dispersion can determine enantioselectivity
AJ Price, ER Johnson
Physical Chemistry Chemical Physics 22 (29), 16571-16578, 2020
122020
A density-functional benchmark of vibrational free-energy corrections for molecular crystal polymorphism
JA Weatherby, AF Rumson, AJA Price, A Otero de la Roza, ER Johnson
The Journal of Chemical Physics 156 (11), 2022
82022
Accurate and efficient polymorph energy ranking with XDM-corrected hybrid DFT
AJA Price, RA Mayo, A Otero-de-la-Roza, ER Johnson
CrystEngComm 25 (6), 953-960, 2023
62023
Comparison of Density-Functional Theory Dispersion Corrections for the DES15K Database
CJ Nickerson, KR Bryenton, AJA Price, ER Johnson
The Journal of Physical Chemistry A 127 (41), 8712-8722, 2023
42023
Small molecule binding to surface-supported single-site transition-metal reaction centres
M DeJong, AJA Price, E Mårsell, G Tom, GD Nguyen, ER Johnson, ...
Nature Communications 13 (1), 7407, 2022
42022
Reducing training data needs with minimal multilevel machine learning (M3L)
S Heinen, D Khan, GF von Rudorff, K Karandashev, DJA Arrieta, ...
arXiv preprint arXiv:2308.11196, 2023
32023
Adaptive hybrid density functionals
D Khan, AJA Price, ML Ach, O Trottier, OA von Lilienfeld
arXiv preprint arXiv:2402.14793, 2024
2024
Supplementary Information for: XDM-corrected hybrid DFT with numerical atomic orbitals predicts molecular crystal lattice energies with unprecedented accuracy
AJA Price, AO de la Roza, ER Johnson
2022
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