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- Currently displaying 3121 - 3140 of 30389 publications
Understanding Molecular Simulation: From Algorithms to Applications, Third Edition
(2023)
1
(doi: 10.1016/c2009-0-63921-0)
Automated pipetting robot for proxy high-throughput viscometry of Newtonian fluids
Digital Discovery
(2023)
2
481
(doi: 10.1039/d2dd00126h)
Catalytic, asymmetric carbon–nitrogen bond formation using metal nitrenoids: from metal–ligand complexes via metalloporphyrins to enzymes
Chemical Science
(2023)
14
12447
(doi: 10.1039/d3sc04661c)
Exploring the chemical space of phenyl sulfide oxidation by automated optimization
Reaction Chemistry & Engineering
(2023)
8
538
(doi: 10.17863/CAM.93992)
Plasmonic noble metal (Ag and Au) nanoparticles: From basics to colorimetric sensing applications
(2023)
1
Chapter Fourteen Convergence of Møller–Plesset perturbation theory for excited reference states
(2023)
88
249
(doi: 10.1016/bs.aiq.2023.01.012)
Water oxidation and oxygen reduction reactions: A mechanistic perspective
(2023)
81
1
Chapter Ten Spin-constrained Hartree–Fock and the generator coordinate method for the 2-site Hubbard model
(2023)
88
161
(doi: 10.1016/bs.aiq.2023.03.014)
Chapter 7 Molecular Dynamics in various ensembles
(2023)
233
Quinone-functionalised carbons as new materials for electrochemical carbon dioxide capture
Journal of Materials Chemistry A
(2023)
11
16221
(doi: 10.1039/d3ta02213g)
Chapter 2 Thermodynamics and statistical mechanics
(2023)
11
A formal framework for security testing of automotive over-the-air update systems
Journal of Logical and Algebraic Methods in Programming
(2023)
130
100812
(doi: 10.1016/j.jlamp.2022.100812)
Modulated self-assembly of hcp topology MOFs of Zr/Hf and the extended 4,4′-(ethyne-1,2-diyl)dibenzoate linker
Crystengcomm
(2023)
25
2119
(doi: 10.1039/d2ce01529c)
Cation disorder dominates the defect chemistry of high-voltage LiMn 1.5 Ni 0.5 O 4 (LMNO) spinel cathodes
Journal of Materials Chemistry A
(2023)
11
13353
(doi: 10.1039/d3ta00532a)
Replication of synthetic recognition-encoded oligomers by ligation of trimer building blocks
Organic Chemistry Frontiers
(2023)
10
5950
(doi: 10.1039/d3qo01717f)