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  • Currently displaying 3161 - 3180 of 30444 publications
Author(s)
Publication title
Journal Name
Publication year
Targeted delivery of nanoparticles to a heterogeneous crude oil zone in an unsaturated porous medium
N Jaberi, S Linley, NR Thomson
Environmental Science: Water Research & Technology
(2023)
9
Cation disorder dominates the defect chemistry of high-voltage LiMn1.5Ni0.5O4 (LMNO) spinel cathodes
J Cen, B Zhu, SR Kavanagh, AG Squires, DO Scanlon
Journal of Materials Chemistry A
(2023)
11
Reaction dynamics as the missing puzzle piece: the origin of selectivity in oxazaborolidinium ion-catalysed reactions
CC Lam, JM Goodman
Chemical Science
(2023)
14
Chapter 15 Rare events
D Frenkel, B Smit
(2023)
Chapter 11 Long-ranged interactions
D Frenkel, B Smit
(2023)
Chapter 14 Time-scale-separation problems in MD
D Frenkel, B Smit
(2023)
Chapter 9 Free energies of solids
D Frenkel, B Smit
(2023)
Expert perceptions of game-changing innovations towards net zero
S Perdana, G Xexakis, K Koasidis, M Vielle, A Nikas, H Doukas, A Gambhir, A Anger-Kraavi, E May, B McWilliams, B Boitier
Energy Strategy Reviews
(2023)
45
Water oxidation and oxygen reduction reactions: A mechanistic perspective
S Chattopadhyay, S Samanta, A Dey
(2023)
81
A practical perspective on the potential of rechargeable Mg batteries
JA Blázquez, RR Maça, O Leonet, E Azaceta, A Mukherjee, Z Zhao-Karger, Z Li, A Kovalevsky, A Fernández-Barquín, AR Mainar, P Jankowski, L Rademacher, S Dey, SE Dutton, CP Grey, J Drews, J Häcker, T Danner, A Latz, D Sotta, MR Palacin, J-F Martin, JMG Lastra, M Fichtner, S Kundu, A Kraytsberg, Y Ein-Eli, M Noked, D Aurbach
Energy and Environmental Science
(2023)
16
Configurational-bias Monte Carlo
D Frenkel, B Smit
(2023)
Temperature dependent fabrication of various rod and rhombohedral-shaped mesoporous Co3O4 crystals and their capability towards elimination of toxic Cr(vi) ions from the aquatic environment
U Sengupta, A Mukherjee, M Periyasamy, S Mukhopadhyay, KJ Jenkinson, AEH Wheatley, A Kar
New Journal of Chemistry
(2023)
47
Development of novel lysine targeting covalent inhibitors for Bruton’s tyrosine kinase and casein kinase 2 and synthesis of novel hybrid androgen receptor inhibitors
RC Bizga Nicolescu
(2023)
A formal framework for security testing of automotive over-the-air update systems
R Kirk, HN Nguyen, J Bryans, SA Shaikh, C Wartnaby
Journal of Logical and Algebraic Methods in Programming
(2023)
130
Accelerating Monte Carlo sampling
D Frenkel, B Smit
(2023)
Chapter Fourteen Convergence of Møller–Plesset perturbation theory for excited reference states
D-G Oprea, HGA Burton
(2023)
88
Sea ice mechanics
F Paul, C Schwarz, RR Audh, J Bluhm, S Johnson, K MacHutchon, T Mielke, A Mishra, T Rampai, T Ricken, A Schwarz, S Skatulla, A Thom, R Verrinder, JR Schr�der, M Vichi, DC Lupascu
Computer Methods in Material Science
(2023)
23
In silico prediction of protodeboronation by a mechanistic DFT-aided algorithm
DS Wigh, M Tissot, P Pasau, JM Goodman, AA Lapkin
Aiche Annual Meeting Conference Proceedings
(2023)
2023-November
Probing the effects of N-terminal acetylation on α-synuclein structure, aggregation and cytotoxicity
R Bell, M Vendruscolo, JR Kumita
Methods in Enzymology
(2023)
686
Functional polymers from CO2 as feedstock
CWS Yeung, GEKK Seah, AYX Tan, SY Tee, JYC Lim, SS Goh
(2023)