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  • Currently displaying 5801 - 5820 of 30304 publications
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Recent developments in the PySCF program package.
Q Sun, X Zhang, S Banerjee, P Bao, M Barbry, NS Blunt, NA Bogdanov, GH Booth, J Chen, Z-H Cui, JJ Eriksen, Y Gao, S Guo, J Hermann, MR Hermes, K Koh, P Koval, S Lehtola, Z Li, J Liu, N Mardirossian, JD McClain, M Motta, B Mussard, HQ Pham, A Pulkin, W Purwanto, PJ Robinson, E Ronca, ER Sayfutyarova, M Scheurer, HF Schurkus, JET Smith, C Sun, S-N Sun, S Upadhyay, LK Wagner, X Wang, A White, JD Whitfield, MJ Williamson, S Wouters, J Yang, JM Yu, T Zhu, TC Berkelbach, S Sharma, AY Sokolov, GK-L Chan
Journal of Chemical Physics
(2020)
153
Non-additive response of the high-latitude Southern Hemisphere climate to aerosol forcing in a climate model with interactive chemistry
JO Pope, A Orr, GJ Marshall, NL Abraham
Atmospheric Science Letters
(2020)
21
Hetero-Coencapsulation within a Supramolecular Cage: Moving away from the Statistical Distribution of Different Guests
C Bravin, G Licini, CA Hunter, C Zonta
Chemistry A European Journal
(2020)
26
Long-term, continuous air quality monitoring in a cross-sectional study of three UK non-domestic buildings
S Stamp, E Burman, C Shrubsole, L Chatzidiakou, D Mumovic, M Davies
Building and Environment
(2020)
180
PSCs initiated by mountain waves in a global chemistry-climate model: A missing piece in fully modelling polar stratospheric ozone depletion
A Orr, JS Hosking, A Delon, L Hoffmann, R Spang, T Moffat-Griffin, J Keeble, NL Abraham, P Braesicke
Atmospheric Chemistry and Physics
(2020)
2020
Half a century of amyloids: Past, present and future
PC Ke, R Zhou, LC Serpell, R Riek, TPJ Knowles, HA Lashuel, E Gazit, IW Hamley, TP Davis, M Fändrich, DE Otzen, MR Chapman, CM Dobson, DS Eisenberg, R Mezzenga
Chem Soc Rev
(2020)
49
Supramolecular catalysis by recognition-encoded oligomers: discovery of a synthetic imine polymerase.
L Gabrielli, CA Hunter
Chemical Science
(2020)
11
Direct Imaging of Correlated Defect Nanodomains in a Metal-Organic Framework.
DN Johnstone, FCN Firth, CP Grey, PA Midgley, MJ Cliffe, SM Collins
Journal of the American Chemical Society
(2020)
142
Biosensing and electrochemical properties of flavin adenine dinucleotide (FAD)-Dependent glucose dehydrogenase (GDH) fused to a gold binding peptide.
H Lee, YS Lee, SS Reginald, S Baek, EM Lee, I-G Choi, IS Chang
Biosens Bioelectron
(2020)
165
Directed Energy Transfer from Monolayer $WS_{2}$ to NIR Emitting PbS-CdS Quantum Dots
AOA Tanoh, N Gauriot, G Delport, J Xiao, R Pandya, JY Sung, J Allardice, Z Li, CA Williams, A Baldwin, SD Stranks, A Rao
(2020)
Identification of Intrinsic Drug Resistance and Its Biomarkers in High-Throughput Pharmacogenomic and CRISPR Screens
I Ayestaran, A Galhoz, E Spiegel, B Sidders, JR Dry, F Dondelinger, A Bender, U McDermott, F Iorio, MP Menden
Patterns
(2020)
1
Copper(II) Complexes of N-Propargyl Cyclam Ligands Reveal a Range of Coordination Modes and Colours, and Unexpected Reactivity
A Counsell, M Yu, M Shi, A Jones, JM Batten, P Turner, M Todd, P Rutledge
(2020)
Investigating the effect of a fluoroethylene carbonate additive on lithium deposition and the solid electrolyte interphase in lithium metal batteries using in situ NMR spectroscopy
AB Gunnarsdóttir, S Vema, S Menkin, LE Marbella, CP Grey
Journal of Materials Chemistry A
(2020)
8
Preparation and characterization of β-Cyclodextrin/Fe3O4 nanocomposite
E Saepudin, SJ Willyam, Irkham, TA Ivandini
IOP Conference Series: Materials Science and Engineering
(2020)
902
Small-Angle Neutron Scattering Reveals the Structural Details of Thermosensitive Polymer-Grafted Cellulose Nanocrystal Suspensions.
F Azzam, B Frka-Petesic, EF Semeraro, F Cousin, B Jean
Langmuir : the ACS journal of surfaces and colloids
(2020)
36
Response to all reviewer comments
J Weber
(2020)
Photoelectrochemical devices with lead halide perovskite and bismuth vanadate light absorbers for unassisted solar fuel synthesis
V Andrei
(2020)
Associating adverse drug effects with protein targets by integrating adverse event, in vitro bioactivity, and pharmacokinetic data
I Smit
(2020)
Operando Identification of the Chemical and Structural Origin of Li-Ion Battery Aging at Near-Ambient Temperature
M-S Kim, B-H Lee, J-H Park, HS Lee, W Hooch Antink, E Jung, J Kim, TY Yoo, CW Lee, C-Y Ahn, SM Kang, J Bok, W Ko, X Wang, S-P Cho, S-H Yu, T Hyeon, Y-E Sung
J Am Chem Soc
(2020)
142
Radical methods for the synthesis of aliphatic amines
N Flodén
(2020)