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  • Currently displaying 3621 - 3640 of 29855 publications
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Perspectives for next generation lithium-ion battery cathode materials
SG Booth, AJ Nedoma, NN Anthonisamy, PJ Baker, R Boston, H Bronstein, SJ Clarke, EJ Cussen, V Daramalla, M De Volder, SE Dutton, V Falkowski, NA Fleck, HS Geddes, N Gollapally, AL Goodwin, JM Griffin, AR Haworth, MA Hayward, S Hull, BJ Inkson, BJ Johnston, Z Lu, JL MacManus-Driscoll, XM De Irujo Labalde, I McClelland, K McCombie, B Murdock, D Nayak, S Park, GE Pérez, CJ Pickard, LFJ Piper, HY Playford, S Price, DO Scanlon, JC Stallard, N Tapia-Ruiz, AR West, L Wheatcroft, M Wilson, L Zhang, X Zhi, B Zhu, SA Cussen
APL Materials
(2021)
9
Enhanced visible light absorption in layered Cs3Bi2Br9 through mixed-valence Sn(ii)/Sn(iv) doping
CJ Krajewska, SR Kavanagh, L Zhang, DJ Kubicki, K Dey, K Gałkowski, CP Grey, SD Stranks, A Walsh, DO Scanlon, RG Palgrave
Chemical Science
(2021)
12
Accelerating Reaction Rates of Biomolecules by Using Shear Stress in Artificial Capillary Systems.
TA Hakala, EV Yates, PK Challa, Z Toprakcioglu, K Nadendla, D Matak-Vinkovic, CM Dobson, R Martínez, F Corzana, TPJ Knowles, GJL Bernardes
Journal of the American Chemical Society
(2021)
143
EAP45 association with budding HIV‐1: Kinetics and domain requirements
B Meng, PP Vallejo Ramirez, KM Scherer, E Bruggeman, JC Kenyon, CF Kaminski, AM Lever
Traffic (Copenhagen, Denmark)
(2021)
22
Synergy conformal prediction applied to large-scale bioactivity datasets and in federated learning.
U Norinder, O Spjuth, F Svensson
J Cheminform
(2021)
13
Mechanochemical Synthesis and Physicochemical Characterization of Previously Unreported Praziquantel Solvates with 2-Pyrrolidone and Acetic Acid.
D Zanolla, L Gigli, D Hasa, MR Chierotti, M Arhangelskis, N Demitri, W Jones, D Voinovich, B Perissutti
Pharmaceutics
(2021)
13
Applying Solid-state NMR Methods to the Study of Organic Shale Rocks
F Panattoni
(2021)
Dissection of the Polar and Non‐Polar Contributions to Aromatic Stacking Interactions in Solution
C Bravin, JA Piękoś, G Licini, CA Hunter, C Zonta
Angewandte Chemie
(2021)
133
Identifizierung von reaktiven Zentren und Oberflächenfallen in Chalkopyrit‐Photokathoden
Y Liu, M Bouri, L Yao, M Xia, M Mensi, M Grätzel, K Sivula, U Aschauer, N Guijarro
Angewandte Chemie
(2021)
133
Cellulose Photonic Pigments
RM Parker, TH Zhao, B Frka-Petesic, S Vignolini
(2021)
Identifying Reactive Sites and Surface Traps in Chalcopyrite Photocathodes
Y Liu, M Bouri, L Yao, M Xia, M Mensi, M Grätzel, K Sivula, U Aschauer, N Guijarro
Angew Chem Int Ed Engl
(2021)
60
Interactions are important: Linking multi-physics mechanisms to the performance and degradation of solid-state batteries
M-C Pang, K Yang, R Brugge, T Zhang, X Liu, F Pan, S Yang, A Aguadero, B Wu, M Marinescu, H Wang, GJ Offer
Materials Today
(2021)
49
Interaction of Amyloid-β-(1-42) Peptide and Its Aggregates with Lipid/Water Interfaces Probed by Vibrational Sum-Frequency Generation Spectroscopy.
S Strazdaite, SJ Roeters, A Sakalauskas, T Sneideris, J Kirschner, KB Pedersen, B Schiøtt, F Jensen, T Weidner, V Smirnovas, G Niaura
The Journal of Physical Chemistry B
(2021)
125
Halogen Bonding Heteroditopic Materials for Cooperative Sodium Iodide Binding and Extraction
A Docker, JG Stevens, PD Beer
Chemistry (Weinheim an der Bergstrasse, Germany)
(2021)
27
Dissection of the Polar and Non-Polar Contributions to Aromatic Stacking Interactions in Solution.
C Bravin, JA Piękoś, G Licini, CA Hunter, C Zonta
Angewandte Chemie International Edition
(2021)
60
Electric field induced tuning of electronic correlation in weakly confining quantum dots
H Huang, D Csontosová, S Manna, Y Huo, R Trotta, A Rastelli, P Klenovský
Physical Review B
(2021)
104
Ab initio Study of Atomic Dynamics and Thermal Properties of Inorganic Clathrates, Chalcogenides and Perovskite Oxides (thesis access confirmation form)
Y Hu
(2021)
N'-(Pyridin-3-ylmethylene)benzenesulfonohydrazide: Crystal structure, DFT, Hirshfeld surface and in silico anticancer studies
IS Ozochukwu, OC Okpareke, DC Izuogu, A Ibezim, OT Ujam, JN Asegbeloyin
European Journal of Chemistry
(2021)
12
F-Divergences and Cost Function Locality in Generative Modelling with Quantum Circuits.
C Leadbeater, L Sharrock, B Coyle, M Benedetti
Entropy (Basel)
(2021)
23
Tris-Pyridyl Ligands and Beyond: Modifications Derived from the Bridgehead and Donor Vector
J Waters
(2021)