Results 181 to 190 of about 8,231,754 (397)

Accurate spin-dependent electron liquid correlation energies for local spin density calculations: a critical analysis

, 1980
S. H. Vosko, L. Wilk, M. Nusair
semanticscholar   +1 more source

Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron density.

Physical Chemistry, Chemical Physics - PCCP, 2017
C. Lefebvre, Gaëtan Rubez, H. Khartabil, J. Boisson, J. Contreras‐García, E. Hénon   +5 more
semanticscholar   +1 more source

Additive Manufacturing of Gradient Stiffness Honeycombs Using Thermoplastic Polyurethane Composite Material Variations

Advanced Engineering Materials, EarlyView.
By combining porous, solid, and carbon fiber‐reinforced thermoplastic polyurethane within a single 3D printed honeycomb structure, this current work achieved precise control over spatial stiffness while ensuring strong interlayer adhesion. The findings demonstrate enhanced energy absorption and densification strain, outperforming traditional uniform ...
Savvas Koltsakidis, Konstantinos Tsongas, Dimitrios Tzetzis   +2 more
wiley   +1 more source

Electron-hole spectra created by adsorption on metals from density functional theory [PDF]

, 2009
Matthias Timmer, Peter Kratzer
openalex   +1 more source

Self-interaction correction to density-functional approximations for many-electron systems

, 1981
J. Perdew, A. Zunger
semanticscholar   +1 more source

X‐Ray Tomography Analysis of Damage Mechanisms in Metal Matrix Syntactic Foams During Compression

Advanced Engineering Materials, EarlyView.
In situ synchrotron X‐ray tomography is used to investigate the internal damage mechanisms of AlSi12 metal matrix syntactic foam with ceramic hollow spheres during compressive loading. It is concluded that a homogeneous distribution of the second‐phase filler material results in a sequential collapse in a localized region; this leads to controlled and ...
Indrajeet Tambe, János Endre Maróti, Imre Norbert Orbulov, Zoltan Hegedűs, Markus Ziehmer, Carl E. Krill III, Håkan Hallberg, Pär A. T. Olsson, Johan Hektor   +8 more
wiley   +1 more source

Micropleated Nanofibrous Filters for High‐Efficiency Submicron Aerosol Filtration: A Comparative Study with Chemical, Biological, Radiological, and Nuclear Gas Mask Filters

Advanced Engineering Materials, EarlyView.
This study presents micropleated filters manufactured by needleless electrospinning. Nanofibers are deposited onto uniaxially pre‐stretched substrates that contract upon release, forming densely packed micropleats. This architecture increases effective surface area without enlarging the filter size, achieving quality factors comparable to those of ...
Aleksandr Fadeev, Kevin Crown, Sean Kinahan, Gabriel Lucero, Hayden Stromsodt, Svetlana Romanova, Yury Salkovskiy   +6 more
wiley   +1 more source

Development and Preliminary In Vivo Study of 3D‐Printed Bioactive Glass Scaffolds with Trabecular Architecture

Advanced Engineering Materials, EarlyView.
This study reports the fabrication of trabecular bioactive glass scaffolds (composition “1d”: 46.1SiO2‐28.7CaO‐8.8MgO‐6.2P2O5‐5.7CaF2‐4.5Na2O wt%) through vat photopolymerization and the relevant results from mechanical testing and in vivo implantation procedures in rabbit femora, showing great promise for bone tissue engineering applications.
Dilshat Tulyaganov, Roberta Gabrieli, Avzal Akbarov, Nigora Nigmatova, Bekhzod Khabilov, Alessandro Schiavi, Martin Schwentenwein, Enrica Verné, Francesco Baino   +8 more
wiley   +1 more source

Electron-density and electrostatic-potential features of orthorhombic chlorine trifluoride

, 2010
Anastasia V. Shishkina, A.I. Stash, Bartolomeo Civalleri, Arkady Ellern, Vladimir G. Tsirelson   +4 more
openalex   +2 more sources

Trace Nickel Activated Biphasic Core‐CuOii/Shell‐CuOi Secondary Microspheres Enable Room Temperature Parts‐Per‐Trillion‐Level NO2 Detection

Advanced Engineering Materials, EarlyView.
An idea of designing novel sensors is proposed by creating appropriate Schottky barriers and vacancies between isomorphous Core‐CuOii/ Shell‐CuOi secondary microspheres and enhancing catalytic and spill‐over effects, and electronegativity via spontaneous biphasic separation, self‐assembly, and trace‐Ni‐doping.
Bala Ismail Adamu, Peipei Chen, Shafia Mukhtar Ibrahim, Mukhtar Lawan Adam, Attia Falak, Mokhotjwa Simon Dhlamini, Hanfu Wang, Lingxiang Jiang, Weiguo Chu   +8 more
wiley   +1 more source