Results 181 to 190 of about 267,752 (279)

Notes on the Jellinek-Berry Thermostated Ideal Gas. [PDF]

J Stat Phys
Butler LT, Sharifi A.
europepmc   +1 more source

A Three‐Dimensional Structural Model for Predicting Magnetic Exchange and Hydrogen Positions in Bis‐μ‐Hydroxido Cu(II) Dimers

European Journal of Inorganic Chemistry, EarlyView.
Magneto‐structural correlation in bis‐μ‐hydroxido Cu(II) dimers: The out‐of‐plane angle (α) of bridging hydroxido groups critically influences the exchange coupling constant (J). A three‐dimensional correlation combining α and the Cu‐OH‐Cu angle (θ) enables computationally accurate J prediction.
Stefani Gamboa‐Ramirez, Khalil Youssef, Rafaello Papadakis, Michel Giorgi, Sylvain Bertaina, A. Jalila Simaan, Maylis Orio   +6 more
wiley   +1 more source

Phase Space Electronic Structure Theory: From Diatomic Lambda-Doubling to Macroscopic Einstein-de Haas. [PDF]

J Phys Chem Lett
Peng L, Qiu T, Bradbury N, Bian X, Bhati M, Littlejohn R, Kidwell NM, Subotnik JE.   +7 more
europepmc   +1 more source

Phenolate‐ and Alcoholate‐Based Chromium N‐Heterocyclic Carbene Complexes: Structural Peculiarities, Magnetometric and Electron Paramagnetic Resonance Study, and Catalytic Ethylene Oligomerization

European Journal of Inorganic Chemistry, EarlyView.
The first low‐oxidation (I/III) state chromium‐complex bearing a O‐chelating NHC ligand has been synthesized and structurally characterized by single‐crystal X‐ray analysis. The formation of the mixed‐valence species was further supported by SQUID magnetometry and high‐field electron paramagnetic resonance (EPR) spectroscopy.
Somnath Bhattacharya, Alexander Allgaier, Wolfgang Frey, Joris van Slageren, Michael R. Buchmeiser   +4 more
wiley   +1 more source

Bridging Vibrations and Spins: Mode-Resolved Spin-Phonon Coupling Revealed through THz EPR/Magnetic IR Simulation. [PDF]

J Phys Chem A
Chen H, van Gastel M, Schnegg A, Neese F.   +3 more
europepmc   +1 more source

Jet Flow Field Analysis of Convergent‐Divergent Nozzle for Hydraulic Perforation for Natural Gas Hydrates

Energy Science &Engineering, EarlyView.
Combining the nozzle structure and wellbore size of the second natural gas hydrate trial production, the CFD is employed to analyze the internal and external flow fields of convergent–divergent cavitation nozzle. Analyzing the influence of various structural parameters of the nozzle on its jet performance, and the nozzle configuration with optimal jet ...
Wang Yingsheng, Yu Yanjiang, Shen Kaixiang, Zhou Jiawei, Zhang Kewei, Zeng Jing   +5 more
wiley   +1 more source

On Kotzig's Perfect Set Problem of Hamiltonian Cycle Decompositions of the Complete Graph

Journal of Combinatorial Designs, EarlyView.
ABSTRACT A Hamiltonian cycle decomposition (HCD) of K n ${K}_{n}$ is a set of Hamiltonian cycles in which each 1‐path of K n ${K}_{n}$ appears exactly once. A Dudeney set of K n ${K}_{n}$ is a set of Hamiltonian cycles in which each 2‐path of K n ${K}_{n}$ appears exactly once.
Nobuaki Mutoh
wiley   +1 more source

Exact Solution and Large-Scale Scaling Analysis of the Imaginary Creutz-Stark Ladder. [PDF]

Entropy (Basel)
Qi Y, Lin H, Lu Q, Long D, Ruan D, Long GL.   +5 more
europepmc   +1 more source

Recent Advances in Photonic Bound States in the Continuum: From Fundamentals to Engineering and Implementation

Laser &Photonics Reviews, EarlyView.
This review summarizes recent progress in meta‐photonics with a focus on bound states in the continuum (BICs) as a powerful platform for light confinement and control. It covers fundamental concepts, design strategies across optical regimes, symmetry breaking for practical quasi‐BICs, tunable and AI‐assisted BIC devices, and emerging applications in ...
Hafiz Saad Khaliq, Hak‐Rin Kim
wiley   +1 more source

Generalized Eigenvalue Problem in Subspace-Based Excited-State Methods for Quantum Computers. [PDF]

J Chem Theory Comput
Kwao PF, Poyyapakkam Sundar S, Gupt B, Asthana A.   +3 more
europepmc   +1 more source