Long-Range Fit: A Software Package for the Representation and Study of Long-Range Molecular Interactions. [PDF]
J Chem Theory ComputBatista-Planas AL +2 more
europepmc +1 more source
Titanium Suboxides Responsible for Electronic Anomaly Near Room Temperature in the Ti3C2Tx MXene
Advanced Functional Materials, EarlyView.Our multi‐technique study reveals that the near‐room‐temperature anomaly in Ti3C2Tx MXene is linked to titanium suboxide nanodomains, including Ti3O5, embedded within the MXene host. Their temperature‐driven transformation provides an alternative explanation to solvent‐ and swelling‐based models and offers new insight into the thermally activated ...
Bence G. Márkus +8 more
wiley +1 more source
Isotropic Q-fractional Brownian motion on the sphere: regularity and fast simulation. [PDF]
Philos Trans A Math Phys Eng SciLang A, Müller B.
europepmc +1 more source
Exploring Pb‐Chelation Chemistry in the Crystallization Dynamics of Halide Perovskites
Advanced Functional Materials, EarlyView.A mechanism of how Pb‐chelation chemistry governs coordination geometry and initial nucleation behavior at the precursor level of halide perovskite, by regulating the deprotonation state of a chelating additive, is elucidated. This allows for innovative reaction‐system design principles that promote coherent growth while suppressing defect formation in
Byeong Jun Kim +13 more
wiley +1 more source
Error minimized LO modeling of electric vehicle integrated off-grid microgrids using Taylor-Laurent series expansion and BBO based optimization under stability and steady state constraints. [PDF]
Sci RepChaudhary R +3 more
europepmc +1 more source
Historical Foundation and Practical Guideline for Ferroelectric Switching Kinetic Studies
Advanced Functional Materials, EarlyView.The P and U pulses in the conventional PUND measurements are not identical because of the interplay between switching current and the measurement circuit components. This circuit effect can lead to a shift in polarization transients and misinterpreted physics in the switching kinetics.
Yi Liang, Pat Kezer, John T. Heron
wiley +1 more source
Measurement noise attenuation in modified Smith predictor and automatic offset controllers for integrator plus dead-time system. [PDF]
Sci RepHuba M, Bistak P, Vrancic D.
europepmc +1 more source
Advanced Functional Materials, EarlyView.Lithium iron phosphate (LFP) accounts for over 50% of the global cathode market, underscoring the need for efficient recycling and regeneration. We propose a dual‐salt carbothermal shock (CTS) strategy using LiI and NaI to in situ repair Li vacancies.
Yanjuan Li +7 more
wiley +1 more source
Interplay Between Phase Evolution, Fe Migration, and Oxygen Redox in O3‐Type NaxFeyMn1−yO2 Cathodes
Advanced Functional Materials, EarlyView.Why do Na‐ion battery cathodes, that are compositionally closely related, follow different structural paths during battery operation? This work shows how Fe content controls when iron atoms migrate from their original sites. Early migration locks the layers and blocks key phase transitions, whereas delayed migration permits fuller structural ...
Morten Johansen +4 more
wiley +1 more source
Optimal Runge approximation for nonlocal wave equations and unique determination of polyhomogeneous nonlinearities. [PDF]
Calc Var Partial Differ EquLin YH, Tyni T, Zimmermann P.
europepmc +1 more source