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  • Currently displaying 1441 - 1460 of 31102 publications
Author(s)
Publication title
Journal Name
Publication year
Data supporting the North Atlantic Climate System Integrated Study (ACSIS) programme, including atmospheric composition; oceanographic and sea-ice observations (2016–2022); and output from ocean, atmosphere, land, and sea-ice models (1950–2050)
AT Archibald, B Sinha, MR Russo, E Matthews, FA Squires, NL Abraham, SJ-B Bauguitte, TJ Bannan, TG Bell, D Berry, LJ Carpenter, H Coe, A Coward, P Edwards, D Feltham, D Heard, J Hopkins, J Keeble, EC Kent, BA King, IR Lawrence, J Lee, CR Macintosh, A Megann, BI Moat, K Read, C Reed, MJ Roberts, R Schiemann, D Schroeder, TJ Smyth, L Temple, N Thamban, L Whalley, S Williams, H Wu, M Yang
Earth System Science Data
(2025)
17
FCIQMC-CASPT2 with Imaginary-Time-Averaged Wave Functions
AA Safari, RJ Anderson, A Alavi, G Li Manni
Journal of chemical theory and computation
(2025)
21
Effect of Exact Exchange on the Energy Landscape in Self-Consistent Field Theory
Y Pillai, HGA Burton, DJ Wales
Journal of chemical theory and computation
(2025)
21
Understanding the Mechanism of Electrochemical CO2 Capture by Supercapacitive Swing Adsorption.
G Mapstone, TM Kamsma, Z Xu, PK Jones, AA Lee, I Temprano, J Lee, MFL De Volder, AC Forse
ACS Nano
(2025)
19
Cooperative CO2 capture via oxalate formation on metal-decorated graphene
IC Popoola, BX Shi, F Berger, A Michaelides, A Zen, D Alfè, YS Al-Hamdani
Physical Review Materials
(2025)
9
Proton-driven lithium separation using alkali-templated coordination cages
X Sun, K Wu, P Teeuwen, P Pracht, D Wales, J Nitschke
(2025)
Chemisorption and physisorption of alcohols on iron(III) oxide-terminated surfaces from nonpolar solvents
IE Salama, RI Slavchov, SV Filip, SM Clarke
Journal of Colloid and Interface Science
(2025)
685
Structural Elucidation of Na2/3NiO2, A Dynamically Stabilised Cathode Phase with Ni Charge- and Na Vacancy- Ordering
JMA Steele, AR Genreith-Schriever, JD Bocarsly, LAV Nagle-Cocco, FN Sayed, M Juramy, CA O'Keefe, F Orlandi, P Manuel, SE Dutton, CP Grey
(2025)
Virtual Integration of Satellite and In-situ Observation Networks (VISION) v1.0: In-Situ Observations Simulator (ISO_simulator)
MR Russo, SL Bartholomew, D Hassell, AM Mason, E Neininger, AJ Perman, DAJ Sproson, D Watson-Parris, NL Abraham
Geoscientific Model Development
(2025)
18
Metal-ligand redox in layered oxide cathodes for Li-ion batteries
MJW Ogley, AS Menon, GC Pandey, GJP Fajardo, BJ Johnston, I McClelland, V Majherova, S Huband, D Tripathy, I Temprano, S Agrestini, V Celorrio, GE Pérez, SG Booth, CP Grey, SA Cussen, LFJ Piper
Joule
(2025)
9
A triad of somatic mutagenesis converges in self-reactive B cells to cause a virus-induced autoimmune disease.
C Young, M Singh, KJL Jackson, MA Field, TJ Peters, S Angioletti-Uberti, D Frenkel, S Ravishankar, M Gupta, JJ Wang, D Agapiou, ML Faulks, G Al-Eryani, F Luciani, TP Gordon, JH Reed, M Danta, A Carr, AD Kelleher, GJ Dore, G Matthews, R Brink, RA Bull, D Suan, CC Goodnow
Immunity
(2025)
58
Compositional and functional diversity of minimal primitive coacervates in a nucleic acid-peptide world
KK Nakashima, FZ Mihoubi, J Saraya, K Russell, F Rahmatova, J Robinson, MJ Maristany, J Huertas, R Rubio-Sánchez, R Collepardo-Guevara, D O'Flaherty, C Bonfio
(2025)
Quantum disorder induced by nuclear tunneling in lattice
Y-C Zhu, J-X Zeng, Q-J Ye, X-Z Li
(2025)
Deletion of the moeA gene in Flavobacterium IR1 drives structural color shift from green to blue and alters polysaccharide metabolism
ÁE Doncel, C Patinios, A Campos, MBW Costa, MV Turkina, M Murace, RHJ Staals, S Vignolini, BE Dutilh, CJ Ingham
(2025)
Transient interactions between the fuzzy coat and the cross-β core of brain-derived Aβ42 filaments
M Milanesi, ZF Brotzakis, M Vendruscolo
Science Advances
(2025)
11
Discovering trends in big data: general discussion
RV Albornoz, D Antypov, G Blanke, I Borges, A Marulanda Bran, J Cheung, CM Collins, N David, GM Day, VL Deringer, C Draxl, A Eardley-Brunt, ML Evans, I Fairlamb, K Fieseler, BA Franklin, J George, J Grundy, J Johal, AV Kalikadien, V Kapil, L Kotopanov, V Kumar, C Kuttner, M Lederbauer, AC Ojeda-Porras, J Pang, M Parkes, M Pemberton, B Ruscic, MR Ryder, K Sakaushi, G Saleh, BM Savoie, P Schwaller, BB Skjelstad, W Sun, T Taniguchi, CR Taylor, S Torrisi, S Vishnoi, A Walsh, R Wu
Faraday Discuss
(2025)
256
Room Temperature Optically and Magnetically Active Edges in Phosphorene Nanoribbons
A Ashoka, AJ Clancy, NA Panjwani, A Cronin, L Picco, ESY Aw, NJM Popiel, A Eaton, TG Parton, RRC Shutt, S Feldmann, R Carey, TJ Macdonald, ME Severijnen, S Kleuskens, LA Muscarella, FR Fischer, HB de Aguiar, RH Friend, J Behrends, PCM Christianen, CA Howard, R Pandya
(2025)
Data-efficient fine-tuning of foundational models for first-principles quality sublimation enthalpies
H Kaur, F Della Pia, I Batatia, XR Advincula, BX Shi, J Lan, G Csányi, A Michaelides, V Kapil
Faraday Discussions
(2025)
256
Optical materials discovery and design with federated databases and machine learning
V Trinquet, ML Evans, CJ Hargreaves, P-P De Breuck, G-M Rignanese
Faraday discussions
(2025)
256
Discovering synthesis targets: general discussion
AS Anker, A Aspuru-Guzik, T Bechtel, F Bigi, KR Briling, B Das, N David, GM Day, VL Deringer, M Dyer, A Eardley-Brunt, ML Evans, R Evans, BA Franklin, AM Ganose, J George, M Goulding, N Hickey, G James, AV Kalikadien, V Kapil, HJ Kulik, V Kumar, C Kuttner, E Lam, M Lederbauer, Y Lou, J Martin, A Marulanda Bran, M Mathea, CJ Pickard, B Ruscic, MR Ryder, V Sabanza Gil, P Schwaller, MHS Segler, W Sun, S Tanovic, W Treyde, A Walsh, R Wu
Faraday Discuss
(2025)
256