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Benjamin X. Shi
Benjamin X. Shi
University of Cambridge
Geverifieerd e-mailadres voor cam.ac.uk - Homepage
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General embedded cluster protocol for accurate modeling of oxygen vacancies in metal-oxides
BX Shi, V Kapil, A Zen, J Chen, A Alavi, A Michaelides
The Journal of Chemical Physics 156 (12), 2022
152022
Many-body methods for surface chemistry come of age: Achieving consensus with experiments
BX Shi, A Zen, V Kapil, PR Nagy, A Grüneis, A Michaelides
Journal of the American Chemical Society 145 (46), 25372-25381, 2023
72023
Direct imaging of charge redistribution due to bonding at atomic resolution via electron ptychography
GT Martinez, BX Shi, TC Naginey, L Jones, CM O'Leary, TJ Pennycook, ...
arXiv preprint arXiv:1907.12974, 2023
72023
To pair or not to pair? Machine-learned explicitly-correlated electronic structure for NaCl in water
N O'Neill, BX Shi, K Fong, A Michaelides, C Schran
arXiv preprint arXiv:2311.01527, 2023
12023
Accurate and efficient structure factors in ultrasoft pseudopotential and projector augmented wave DFT
BX Shi, RJ Nicholls, JR Yates
Physical Review B 108 (11), 115112, 2023
12023
Going for Gold(-Standard): Attaining Coupled Cluster Accuracy in Oxide-Supported Nanoclusters
BX Shi, A Michaelides, CW Myung
arXiv preprint arXiv:2311.01426, 2023
2023
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Artikelen 1–6