Mechanistic Origins of Structural Failure in Deeply‐Lithiated LixMoS2
ENERGY &ENVIRONMENTAL MATERIALS, EarlyView.Global optimization and ab initio molecular dynamics reveal how Li drives the 2H to 1T′ phase transformation in MoS2 and where the layered framework begins to fracture. Controlled pre‐lithiation stabilizes 1T′ and significantly delays the onset of structural failure, while opening out‐of‐plane Li pathways, offering design rules for robust, high‐rate ...
Gunyoung Heo +4 more
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Why does formalism exist in local environmental rectification? A qualitative comparative analysis based on Central Environmental Protection Inspection cases. [PDF]
PLoS OneLu Z, Gao L, Wu J, Li X.
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Superfield formalism for N=1 broken supersymmetry in 3D gauge theories
, 2011 E. A. Gallegos, A. J. da Silva
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Thermodynamic formalism for interval applications.
, 2023 Rafael Vieira de Paulo
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Rigid Ligand Environments at Beryllium, From Spectroscopic Probes to Small Molecule Activation
European Journal of Inorganic Chemistry, EarlyView.Due to the high rigidity and definition of beryllium scorpionate complexes, they can be used to study metal‐pseudohalide and ‐carbon bonds in detail. Furthermore, these compounds can be used to activate small molecules and exhibit unprecedented transmetalation reactions. In beryllium scorpionate complexes, three of the four available coordination sites
Magnus R. Buchner, Chantsalmaa Berthold
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No-Signaling in Steepest Entropy Ascent: A Nonlinear, Non-Local, Non-Equilibrium Quantum Dynamics of Composite Systems Strongly Compatible with the Second Law. [PDF]
Entropy (Basel)Ray RK, Beretta GP.
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How (not) to Cage an Electron: The Perfluoro Cage Effect as an Extrinsic Molecular Property
Helvetica Chimica Acta, EarlyView.A rigorous definition within Kohn–Sham density functional theory is presented for the notion of an caged electron inside perfluorinated fullerenes as radical anions. ABSTRACT The notion of a (molecular) electron cage was coined for the unique hosting capacity of perfluorocubane, suggesting the “encapsulation of an electron” within the highly symmetric ...
Andreas Riedmiller +2 more
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Mesh variational r-adaptivity for sharp modeling of brittle fracture
Dony G, Moës N, Remacle J.
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Complex Time Approach to the Hamiltonian and the Entropy Production of the Damped Harmonic Oscillator. [PDF]
Entropy (Basel)Aslani KE.
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Determinants of Employee Victory in Telecommuting Labor Disputes: A Configurational Approach
Human Resource Management, EarlyView.ABSTRACT The rapid expansion of telecommuting during the COVID‐19 pandemic created novel disputes over remote‐work conditions that existing laws did not clearly regulate. This study investigates the configurational determinants of employee victory in these disputes. Drawing on resource‐based and institutional theories of litigation outcomes, we propose
Zhenwu Jiang +3 more
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