Search Results - "Israel journal of chemistry"

Empirical Double‐Hybrid Density Functional Theory: A ‘Third Way’ in Between WFT and DFT by Martin, Jan M. L., Santra, Golokesh

“…Double hybrid density functional theory arguably sits on the seamline between wavefunction methods and DFT: it represents a special case of Rung 5 on the…”
Get full text

Tackling Remote sp3 C−H Functionalization via Ni‐Catalyzed “chain‐walking” Reactions by Janssen‐Müller, Daniel, Sahoo, Basudev, Sun, Shang‐Zheng, Martin, Ruben

“…Nickel catalysts have recently played an important role for rapidly and reliably converting feedstock chemicals into valuable compounds of interest for both…”
Get full text

Photoredox‐Mediated Net‐Neutral Radical/Polar Crossover Reactions by Wiles, Rebecca J., Molander, Gary A.

“…Radical/Polar Crossover (RPC) chemistry is a rapidly growing subset of photoredox catalysis that is characterized by transformations featuring both radical and…”
Get full text

Supramolecular Polymers – we've Come Full Circle by Aida, Takuzo, Meijer, E.W.

“…Since the first polymers were discovered, scientists have debated their structures. Before Hermann Staudinger published the brilliant concept of…”
Get full text

Recent Advances in Transition Metal‐Catalyzed Functionalization of gem‐Difluoroalkenes by Koley, Suvajit, Altman, Ryan A.

“…gem‐Difluorinated alkenes are readily accessible building blocks that can undergo functionalization to provide a broad spectrum of fluorinated and…”
Get full text

Electrochemical CO2 Reduction: Recent Advances and Current Trends by Jones, John-Paul, Prakash, G. K. Surya, Olah, George A.

“…With rising levels of CO2 in our atmosphere, technologies capable of converting CO2 into useful products have become more valuable. The field of…”
Get full text

On the Definition of Chirality and Enantioselective Fields by Kishine, Jun‐ichiro, Kusunose, Hiroaki, Yamamoto, Hiroshi M.

“…In solid state physics, any symmetry breaking is known to be associated with emergence of an order parameter. However, the order parameter for molecular and…”
Get full text

ConSurf: Using Evolutionary Data to Raise Testable Hypotheses about Protein Function by Celniker, Gershon, Nimrod, Guy, Ashkenazy, Haim, Glaser, Fabian, Martz, Eric, Mayrose, Itay, Pupko, Tal, Ben-Tal, Nir

“…Many mutations disappear from the population because they impair protein function and/or stability. Thus, amino acid positions that are essential for proper…”
Get full text

Transition‐Metal‐Catalyzed 1,2‐Carboboration of Alkenes: Strategies, Mechanisms, and Stereocontrol by Liu, Zhen, Gao, Yang, Zeng, Tian, Engle, Keary M.

“…During the past decade, many research groups have described catalytic methods for 1,2‐carboboration, allowing access to structurally complex organoboronates…”
Get full text

The Fluorine Gauche Effect: A Brief History by Thiehoff, Christian, Rey, Yannick P., Gilmour, Ryan

“…Transforming the fluorine gauche effect from an academic curiosity into a powerful acyclic conformational control strategy has enriched molecular design. This…”
Get full text

Issues and Challenges for Bulk-Type All-Solid-State Rechargeable Lithium Batteries using Sulfide Solid Electrolytes by Jung, Yoon Seok, Oh, Dae Yang, Nam, Young Jin, Park, Kern Ho

“…As lithium rechargeable batteries are considered a potential candidate for large‐scale energy storage applications in devices such as electric vehicles (EVs)…”
Get full text

Recent Development on Anodes for Na-Ion Batteries by Bommier, Clement, Ji, Xiulei

“…New discoveries in anode materials for sodium ion batteries (NIBs) are highly necessary to achieve the goals of widespread applications, such as electric…”
Get full text

Mathematical Analysis of Chemical Reaction Systems by Yu, Polly Y., Craciun, Gheorghe

“…The use of mathematical methods for the analysis of chemical reaction systems has a very long history, and involves many types of models: deterministic versus…”
Get full text

Applications of Cucurbit[n]urils (n=7 or 8) in Pharmaceutical Sciences and Complexation of Biomolecules by Yin, Hang, Wang, Ruibing

“…Cucurbit[7]uril (CB[7]) and cucurbit[8]uril (CB[8]) are two key members of the cucurbit[n]uril (CB[n]) family of macrocycles. Because of the good water…”
Get full text

Development of Palladium Precatalysts that Efficiently Generate LPd(0) Active Species by Shaughnessy, Kevin H.

“…Palladium catalysts have become central to modern organic synthesis, particularly in the context of cross‐coupling reactions to form C−C and C‐heteroatom…”
Get full text

MIL‐53 and its Isoreticular Analogues: a Review of the Chemistry and Structure of a Prototypical Flexible Metal‐Organic Framework by Millange, Franck, Walton, Richard I.

“…We present a review of the structural chemistry of metal‐organic framework materials with the MIL‐53 type structure. This family of materials is well‐known for…”
Get full text

Why Do We Need More Active ATRP Catalysts? by Lorandi, Francesca, Matyjaszewski, Krzysztof

“…Atom transfer radical polymerization (ATRP) is a staple technique for the preparation of polymers with well‐defined architecture. In ATRP, the catalyst governs…”
Get full text

How and Why Do Cluster Size, Charge State, and Ligands Affect the Course of Metal-Mediated Gas-Phase Activation of Methane? by Schwarz, Helmut

“…Recent progress in the gas‐phase activation of methane is discussed. We demonstrate that cluster size, charge state, and ligands crucially affect both the…”
Get full text

Helical Chirality of Supramolecular Columns and Spheres Self‐Organizes Complex Liquid Crystals, Crystals, and Quasicrystals by Percec, Virgil, Xiao, Qi

“…Homochiral helical self‐organizations provide some of the most fundamental architectures of biological macromolecules and of their co‐assemblies although they…”
Get full text

Evaluation of Polaron Transport in Solids from First‐principles by Natanzon, Yuriy, Azulay, Amram, Amouyal, Yaron

“…Polarons are formed in polar or ionic solids, either molecular or crystalline, due to local distortions of the lattice induced by charge carriers. Polaron…”
Get full text