Results 141 to 150 of about 11,063,462 (189)

An exciting Approach to Theoretical Spectroscopy. [PDF]

Adv Sci (Weinh)
Raya-Moreno M, Buccheri A, Dasch NA, Farahani N, Gonzalez Oliva I, Gulans A, Hong S, Hossain M, Kleine H, Kuban M, Lubeck S, Maurer B, Pavone P, Peschel F, Popova-Gorelova D, Qiao L, Richter E, Rigamonti S, Pela RR, Schebek M, Sinha K, Speckhard DT, Stutz J, Tillack S, Tumakov D, Užulis J, Voiculescu M, Vona C, Yang M, Draxl C.   +29 more
europepmc   +1 more source

Maximum‐Entropy‐Based Meshless Modeling of Surface‐Tension‐Driven Large Deformation

International Journal for Numerical Methods in Engineering, Volume 127, Issue 17, 15 September 2026.
ABSTRACT Soft material modeling is challenging due, among others, to the substantial structural changes these materials undergo. In this context, meshless methods offer a promising alternative to overcome the limitations of established mesh‐based approximations such as finite elements. However, they introduce new challenges.
Rodrigo Castillo‐Acuna, Nicholas Gianotti, Dennis M. Kochmann   +2 more
wiley   +1 more source

Computational discovery of marine natural phytochemicals as novel SIRT7 inhibitors for cancer treatment. [PDF]

J Genet Eng Biotechnol
Tanjida Islam KM, Khanam R, Mahmud S.
europepmc   +1 more source

Hybrid Coupling With Operator Inference and the Overlapping Schwarz Alternating Method

International Journal for Numerical Methods in Engineering, Volume 127, Issue 17, 15 September 2026.
ABSTRACT This paper presents a hybrid approach for coupling subdomain‐local, nonintrusive Operator Inference (OpInf) reduced order models (ROMs) with each other and with subdomain‐local, high‐fidelity full order models (FOMs) using the overlapping Schwarz alternating method (O‐SAM).
Irina Tezaur, Eric Parish, Anthony Gruber, Ian Moore, Christopher Wentland, Alejandro Mota   +5 more
wiley   +1 more source

Exploring thermophysical properties of CoCrFeNiCu high entropy alloy via molecular dynamics simulations. [PDF]

Heliyon
Liu F, Liu Y, Jiang XZ, Xia J.
europepmc   +1 more source

A Two Degree of Freedom Approach for Discrete‐Time Sliding Mode Control

International Journal of Robust and Nonlinear Control, Volume 36, Issue 13, Page 6540-6551, 10 September 2026.
ABSTRACT This paper proposes a new two degree of freedom (2‐DOF) framework for discrete‐time sliding mode control (DSMC) that decouples the disturbed evolution from its nominal counterpart. The novel nominal/disturbed subsystem separation for DSMC can be used to define multiple closed‐loop specifications. The nominal regulation (or tracking) controller
Tito L. M. Santos, Ary M. Batista
wiley   +1 more source

Modeling Dislocation Cutting of γ′ Precipitates in Ni‐Base Superalloys: Linking Atomistic and Dislocation Dynamics Simulations

Advanced Engineering Materials, Volume 28, Issue 17, 9 September 2026.
Dislocation cutting of γ′ precipitates in Ni‐based superalloys is investigated by linking atomistic simulations with discrete dislocation dynamics. The critical cutting stress is shown to be governed by the antiphase boundary energy, while line tension effects promote edge‐preferred cutting.
Frédéric Houllé, Siwen Gao, Marc Fivel, Anxin Ma, Daria Smirnova, Sriram Anand, Arun Prakash, Julien Guénolé, Alexander Hartmaier, Erik Bitzek   +9 more
wiley   +1 more source

Pendulum-like hemilability in a Ti-based frustrated Lewis Trio. [PDF]

Chem Sci
Kounalis E, van Tongeren D, Melnikov S, Lutz M, Broere DLJ.   +4 more
europepmc   +1 more source

Unified Phase‐Field Framework for Antiferroelectric, Ferroelectric and Dielectric Phases: Application to HZO Thin Films

Advanced Functional Materials, Volume 36, Issue 77, 24 September 2026.
HfxZr1−xO2${\rm Hf}_x{\rm Zr}_{1-x}{\rm O}_2$ offers CMOS‐compatible nanoscale ferroelectricity yet suffers from a high Ec${\rm E}_c$ demanding large operating voltages. A unified phase‐field framework spanning AFE/FE/DE phases shows how FE grains soften neighboring AFE grains over λ$\lambda$ ≈$\approx$ 22–37 nm.
P. Pankaj, Sandeep Sugathan, Jiyoung Kim, Si Joon Kim, Pil‐Ryung Cha   +4 more
wiley   +1 more source

Magnetically Driven Biofabrication for Tissue Engineering: From Nanoparticle Design to Mag‐ATMP Translation

Advanced Healthcare Materials, Volume 15, Issue 36, 25 September 2026.
Magnetically responsive nanoparticles enable remote control over biomaterials, cells, and engineered tissues. This review summarizes material design, biological safety, fabrication and actuation strategies, computational validation, and translational pathways that support the development of magnetic tissue‐engineering platforms and future magnetically ...
Konstantinos Ioannidis, Dimitrios Lefas, Maya Guilliams, Jackie Van Grootenbril, Isaak Decoene, Dimitrios Sakellariou, Bart Smeets, Stefanos Mourdikoudis, Ioannis Papantoniou   +8 more
wiley   +1 more source