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  • Currently displaying 3081 - 3100 of 30372 publications
Author(s)
Publication title
Journal Name
Publication year
Remodelling Surface Site Interaction Points
MC Storer
(2023)
Cation disorder dominates the defect chemistry of high-voltage LiMn 1.5 Ni 0.5 O 4 (LMNO) spinel cathodes
J Cen, B Zhu, SR Kavanagh, AG Squires, DO Scanlon
Journal of Materials Chemistry A
(2023)
11
Enantioselective C–C bond formation in complex multicatalytic systems
L Veth, P Dydio
(2023)
73
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
Chapter 15 Rare events
D Frenkel, B Smit
(2023)
Chapter 12 Configurational-bias Monte Carlo
D Frenkel, B Smit
(2023)
Catalytic, asymmetric carbon–nitrogen bond formation using metal nitrenoids: from metal–ligand complexes via metalloporphyrins to enzymes
A Fanourakis, RJ Phipps
Chemical Science
(2023)
14
Cu2SiSe3 as a promising solar absorber: harnessing cation dissimilarity to avoid killer antisites
A Nicolson, SR Kavanagh, CN Savory, GW Watson, DO Scanlon
Journal of Materials Chemistry A
(2023)
11
Chapter Ten Spin-constrained Hartree–Fock and the generator coordinate method for the 2-site Hubbard model
S De Baerdemacker, A Ayati, HGA Burton, X De Vriendt, P Bultinck, G Acke
(2023)
88
Understanding the limits of Li-NMC811 half-cells
RC McNulty, E Hampson, LN Cutler, CP Grey, WM Dose, LR Johnson
Journal of Materials Chemistry A
(2023)
11
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 & Environmental Science
(2023)
16
Quinone-functionalised carbons as new materials for electrochemical carbon dioxide capture
NA Hartley, SM Pugh, Z Xu, DCY Leong, A Jaffe, AC Forse
Journal of Materials Chemistry A
(2023)
11
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 and Technology
(2023)
9
Biophysical characterization of biomolecular condensates through microfluidic technologies
T Welsh
(2023)
Temperature dependent fabrication of various rod and rhombohedral-shaped mesoporous Co 3 O 4 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
Manipulating morphology and composition in colloidal heterometallic nanopods and nanodendrites
S Ming, AEH Wheatley
Nanoscale
(2023)
15
Chapter Fourteen Convergence of Møller–Plesset perturbation theory for excited reference states
D-G Oprea, HGA Burton
(2023)
88
Free energy of chain molecules
D Frenkel, B Smit
(2023)
Chapter 6 Monte Carlo simulations in various ensembles
D Frenkel, B Smit
(2023)
Water oxidation and oxygen reduction reactions: A mechanistic perspective
S Chattopadhyay, S Samanta, A Dey
(2023)
81