Results 111 to 120 of about 14,177,191 (172)

Strong Implications From Small Deviations in Labeling Patterns: The Mechanism of Burkholderia gladioli Pacifigorgiadiene Synthase. [PDF]

Chemistry
Yin Z, Hu Z, He X, Xu J, Goldfuss B, Dickschat JS, Bian G.   +6 more
europepmc   +1 more source

Ultrabroadband plug-and-play photonic tensor core packaging with sub-dB loss. [PDF]

Sci Adv
Jung E, Gehring H, Brückerhoff-Plückelmann F, Krämer L, Vazquez-Martel C, Blasco E, Pernice W.   +6 more
europepmc   +1 more source

On Algebraic and Geometric Kekulé Structures in Benzenoid Rotagraphs

, 2006
Ante Graovac, Damir Vukičević, Janez Žerovnik   +2 more
openalex   +1 more source

Unexpected structural isomers of AlFe₂O₄ ⁺ and AlCo₂O₄ ⁺: vibrational spectroscopy and ion mobility combined with quantum chemistry. [PDF]

Chem Sci
Schwedland W, Penna TC, Windeck H, Müller F, Leach S, Sauer J, Advincula XR, Berger F, Ishida N, Ohshimo K, Misaizu F, Li YK, Chakraborty A, Horn F, Asmis KR.   +14 more
europepmc   +1 more source

Controlling Electronic Coherences and the Curvature Induced by the Derivative Coupling at a Conical Intersection: A Quantum Ehrenfest (QuEh) Protocol for Reaction Path Following Application to "Channel 3" Benzene Photochemistry. [PDF]

J Phys Chem A
Worth GA, Robb MA.
europepmc   +1 more source

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Minimum Number of Kekulé Structures of Certain Benzenoid Graphs and -Polyacenic Nanotubes

Polycyclic aromatic compounds (Print), 2022
In a molecular graph, a Kekulé structure and perfect matching resembles the same. Thus, the number of Kekulé structure(chemically) is equal to the number of perfect matching (mathematically) required to cover the edge set or covalent bonds of a molecular
S. Little, S. Maria, Jesu Raja, S. Raja
semanticscholar   +1 more source

Kekulé structures of honeycomb lattice on Klein bottle and Möbius strip

, 2021
In organic chemistry, there are strong connections between the number of the Kekule structures and chemical properties for many molecules. In this paper, we focus on some honeycomb lattices on Klein bottle and Mobius strip. We obtain explicit expressions
Xing Feng, Lian-zhu Zhang, Mingzu Zhang
semanticscholar   +1 more source

Air stable high-spin blatter diradicals: non-Kekulé versus Kekulé structures

Journal of Materials Chemistry C, 2019
1,2,4-Benzotriazinyl based stable diradicals possess singlet ground states and small singlet–triplet energy gaps with a thermal accessible triplet excited state.
Xiaoguang Hu, Lei Zhao, Hanjiao Chen, Yousong Ding, Yanzhen Zheng, Mao Miao, Yonghao Zheng   +6 more
semanticscholar   +1 more source