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Yusuf Hamied Department of Chemistry

 

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  • Currently displaying 981 - 1000 of 29414 publications
Can GW Handle Multireference Systems
A Ammar, A Marie, M Rodríguez-Mayorga, HGA Burton, P-F Loos
– The Journal of chemical physics
(2024)
160,
114101
(doi: 10.1063/5.0196561)
Can $GW$ Handle Multireference Systems?
A Ammar, A Marie, M Rodríguez-Mayorga, HGA Burton, P-F Loos
– Journal of Chemical Physics
(2024)
(doi: 10.48550/arxiv.2401.03745)
Palladium (II)-Catalyzed C-H Activation with Bifunctional Ligands: From Curiosity to Industrialization.
K Wu, N Lam, DA Strassfeld, Z Fan, JX Qiao, T Liu, D Stamos, J-Q Yu
– Angewandte Chemie (International ed. in English)
(2024)
63,
e202400509
(doi: 10.1002/anie.202400509)
Electrostatic [FeFe]-hydrogenase-carbon nitride assemblies for efficient solar hydrogen production
Y Liu, C Pulignani, S Webb, SJ Cobb, S Rodríguez-Jiménez, D Kim, RD Milton, E Reisner
– Chemical science
(2024)
15,
6088
(doi: 10.1039/d4sc00640b)
Insights into charge transfer dynamics of Li batteries through temperature-dependent electrochemical impedance spectroscopy (EIS) utilizing symmetric cell configuration
MA Zabara, G Katırcı, FE Civan, A Yürüm, SA Gürsel, B Ülgüt
– Electrochimica Acta
(2024)
485,
144080
(doi: 10.1016/j.electacta.2024.144080)
Suppression of Dexter transfer by covalent encapsulation for efficient matrix-free narrowband deep blue hyperfluorescent OLEDs
H-H Cho, DG Congrave, AJ Gillett, S Montanaro, HE Francis, V Riesgo-Gonzalez, J Ye, R Chowdury, W Zeng, MK Etherington, J Royakkers, O Millington, AD Bond, F Plasser, JM Frost, CP Grey, A Rao, RH Friend, NC Greenham, H Bronstein
– Nature materials
(2024)
23,
1
(doi: 10.1038/s41563-024-01812-4)
Translational eigenstates of He@C60 from four-dimensional ab initio potential energy surfaces interpolated using Gaussian process regression
K Panchagnula, D Graf, FEA Albertani, AJW Thom
– J Chem Phys
(2024)
160,
104303
(doi: 10.1063/5.0197903)
Estimating the causal effect of temperature on ozone air pollution
S Hickman, P Griffiths, P Nowack, A Archibald
(2024)
(doi: 10.5194/egusphere-egu24-12694)
Ligand-Directed Self-Assembly of Organic-Semiconductor/Quantum-Dot Blend Films Enables Efficient Triplet Exciton-Photon Conversion
V Gray, DTW Toolan, S Dowland, JR Allardice, MP Weir, Z Zhang, J Xiao, A Klimash, JF Winkel, EK Holland, GM Fregoso, JE Anthony, H Bronstein, R Friend, AJ Ryan, RAL Jones, NC Greenham, A Rao
– J Am Chem Soc
(2024)
146,
7763
(doi: 10.1021/jacs.4c00125)
Rationale for the extrapolation procedure in selected configuration interaction
HGA Burton, P-F Loos
– The Journal of chemical physics
(2024)
160,
104102
(doi: 10.1063/5.0192458)
Low-temperature Open-atmosphere Growth of WO3 Thin Films with Tunable and High-performance Photoresponse
Z Sun, S Bhattacharjee, M Xiao, W Li, MO Hill, RA Jagt, LV Delumeau, KP Musselman, E Reisner, J MacManus-Driscoll
– Journal of Materials Chemistry C
(2024)
12,
4779
(doi: 10.1039/D3TC02257A)
Understanding Biology in the Age of Artificial Intelligence
E Lawrence, A El-Shazly, S Seal, CK Joshi, P Liò, S Singh, A Bender, P Sormanni, M Greenig
(2024)
(link to publication)
A deep dive into the liquid droplet state of α-synuclein
ST Dada
(2024)
(doi: 10.17863/CAM.114651)
PromptSMILES: Prompting for scaffold decoration and fragment linking in chemical language models
M Thomas, M Ahmad, G Tresadern, G de Fabritiis
(2024)
(doi: 10.26434/chemrxiv-2024-z5jnt)
MolScore: A scoring and evaluation framework for de novo drug design
M Thomas, NM O'Boyle, A Bender, C de Graaf
(2024)
(doi: 10.26434/chemrxiv-2023-c4867)
Susceptibility of hypertensive individuals to acute blood pressure increases in response to personal-level environmental temperature decrease.
Y Xu, Y Han, W Chen, L Chatzidiakou, L Yan, A Krause, Y Li, H Zhang, T Wang, T Xue, Q Chan, B Barratt, RL Jones, J Liu, Y Wu, M Zhao, J Zhang, FJ Kelly, T Zhu
– Environment International
(2024)
185,
108567
(doi: 10.1016/j.envint.2024.108567)
Impacts of Supercapacitor Electrode Structure on Electrochemical CO2 Capture
Z Xu, G Mapstone, Z Coady, M Wang, T Spreng, X Liu, A Forse
(2024)
(doi: 10.26434/chemrxiv-2023-nj817-v2)
Fabrication of gradient hydrogels using a thermophoretic approach in microfluidics
A Kosmidis Papadimitriou, SW Chong, Y Shen, OS Lee, TPJ Knowles, LM Grover, D Vigolo
– Biofabrication
(2024)
16,
025023
(doi: 10.1088/1758-5090/ad2b05)
Dynamic mechanostereochemical switching of a co-conformationally flexible [2]catenane controlled by specific ionic guests.
Y Yao, YC Tse, SK-M Lai, Y Shi, K-H Low, HY Au-Yeung
– Nature communications
(2024)
15,
1952
(doi: 10.1038/s41467-024-46099-w)
Azobenzene isomerization on a reactive copper surface by efficient decoupling with bulky side groups
S Jaekel, R Stoll, F Berger, S Hecht, L Grill
– Surface Science
(2024)
744,
122468
(doi: 10.1016/j.susc.2024.122468)

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