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  • Currently displaying 2081 - 2100 of 29852 publications
Author(s)
Publication title
Journal Name
Publication year
Design and Frabication of Optical Li+ Sensors for Application in Li-ion Batteries
H Francis
(2023)
TREXIO: A file format and library for quantum chemistry.
E Posenitskiy, VG Chilkuri, A Ammar, M Hapka, K Pernal, R Shinde, EJ Landinez Borda, C Filippi, K Nakano, O Kohulák, S Sorella, P de Oliveira Castro, W Jalby, PL Ríos, A Alavi, A Scemama
The Journal of Chemical Physics
(2023)
158
Finding Excited-state Minimum Energy Crossing Points on a Budget: Non-self-consistent Tight-Binding Methods
P Pracht, C Bannwarth
Journal of Physical Chemistry Letters
(2023)
14
A Photoredox Reaction for the Selective Modification of 5‑Carboxycytosine in DNA
BJ Mortishire-Smith, SM Becker, A Simeone, L Melidis, S Balasubramanian
Journal of the American Chemical Society
(2023)
145
A Hybrid-DFT Study of Intrinsic Point Defects in $MX_2$ ($M$=Mo, W; $X$=S, Se) Monolayers
A Akkoush, Y Litman, M Rossi
(2023)
Excited States, Symmetry Breaking, and Unphysical Solutions in State-Specific CASSCF Theory.
A Marie, HGA Burton
Journal of Physical Chemistry A
(2023)
127
Expanding Transition Metal-Mediated Bioorthogonal Decaging to Include C-C Bond Cleavage Reactions.
GM Dal Forno, E Latocheski, A Beatriz Machado, J Becher, L Dunsmore, AL St John, BL Oliveira, CD Navo, G Jiménez-Osés, R Fior, JB Domingos, GJL Bernardes
J Am Chem Soc
(2023)
145
Aza-Cibalackrot: Turning on Singlet Fission Through Crystal Engineering.
M Purdy, JR Walton, KJ Fallon, DTW Toolan, P Budden, W Zeng, MK Corpinot, D-K Bučar, L van Turnhout, R Friend, A Rao, H Bronstein
Journal of the American Chemical Society
(2023)
145
Glucagon-like peptide 1 aggregates into low-molecular-weight oligomers off-pathway to fibrillation.
E Přáda Brichtová, M Krupová, P Bouř, V Lindo, A Gomes Dos Santos, SE Jackson
Biophysical journal
(2023)
122
High-density volumetric super-resolution microscopy
S Daly, JF Fernandes, E Bruggeman, A Handa, R Peters, S Benaissa, B Zhang, JS Beckwith, EW Sanders, RR Sims, D Klenerman, SJ Davis, K O’Holleran, SF Lee
(2023)
Trapping of Photoluminescent Kinetic Intermediates During High-Concentration Synthesis of Non-Emissive Metal-Organic Frameworks
A Halder, D Bain, T Pitt, Z Shi, J Oktawiec, J-H Lee, S Tsangari, M Ng, J Fuentes-Rivera, A Forse, T Runcevski, D Muller, A Musser, P Milner
(2023)
Diffusion-assisted displacive transformation in Yttrium-doped Sb2Te3 phase change materials
K Li, B Liu, J Zhou, SR Elliott, Z Sun
Acta Materialia
(2023)
249
Characterisation of neurodegenerative diseases derived protein aggregates using improved single-molecule pull-down
Y Zhang
(2023)
AbNatiV: VQ-VAE-based assessment of antibody and nanobody nativeness for hit selection, humanisation, and engineering
A Ramon, M Ali, M Atkinson, A Saturnino, K Didi, C Visentin, S Ricagno, X Xu, M Greenig, P Sormanni
(2023)
The Structural Stability Limit of Layered Lithium Transition Metal Oxides Due to Oxygen Release at High State of Charge and Its Dependence on the Nickel Content
S Oswald, HA Gasteiger
Journal of The Electrochemical Society
(2023)
170
The Intermetallic Reactivity Database: Compiling Chemical Pressure and Electronic Metrics toward Materials Design and Discovery
JS Van Buskirk, JD Kraus, DC Fredrickson
Chemistry of Materials
(2023)
35
Understanding Lithium-Ion Dynamics in Single-Ion and Salt-in-Polymer Perfluoropolyethers and Polyethyleneglycol Electrolytes Using Solid-State NMR
CV Amanchukwu, AB Gunnarsdóttir, S Choudhury, TL Newlove, PCMM Magusin, Z Bao, CP Grey
Macromolecules
(2023)
56
Secondary Bracing Ligands Drive Heteroleptic Cuboctahedral PdII12 Cage Formation
CF Espinosa, TK Ronson, JR Nitschke
J Am Chem Soc
(2023)
145
Surfaces for Study of Receptor Dynamics on T Cells
J McColl, D Klenerman
Methods in Molecular Biology
(2023)
2654
Floatable photocatalytic hydrogel nanocomposites for large-scale solar hydrogen production.
WH Lee, CW Lee, GD Cha, B-H Lee, JH Jeong, H Park, J Heo, MS Bootharaju, S-H Sunwoo, JH Kim, KH Ahn, D-H Kim, T Hyeon
Nat Nanotechnol
(2023)
18