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Physical Chemistry Chemical Physics : PCCP|June 16, 2026
Intrinsic origin of anomalous double-layer capacitance on Pt(111) revealed by grand canonical density functional theoryJordan Clive Barker, Jessica Jein White, Assil Bouzid, et al.The Journal of Physical Chemistry. B|November 30, 2020
Atomic Structure of Glassy GeTe<sub>4</sub> as a Playground to Assess the Performances of Density Functional Schemes Accounting for Dispersion ForcesPier Luigi Silvestrelli, Evelyne Martin, Mauro Boero, et al.RSC Advances|April 15, 2022
First-principles thermal transport in amorphous Ge<sub>2</sub>Sb<sub>2</sub>Te<sub>5</sub> at the nanoscaleThuy-Quynh Duong, Assil Bouzid, Carlo Massobrio, et al.Physical Chemistry Chemical Physics : PCCP|January 9, 2025
Insights into the structural complexity and local disorder of crystalline AsTe<sub>3</sub> from semi-automated first-principles modellingSylvian Cadars, Olivier Masson, Jean-Paul Laval, et al.The Journal of Chemical Physics|March 1, 2023
Impact of the local atomic structure on the thermal conductivity of amorphous Ge<sub>2</sub>Sb<sub>2</sub>Te<sub>5</sub>Mohammed Guerboub, Steve Dave Wansi Wendji, Carlo Massobrio, et al.The Journal of Chemical Physics|September 3, 2016
Structure of amorphous GeSe9 by neutron diffraction and first-principles molecular dynamics: Impact of trajectory sampling and size effectsSébastien Le Roux, Assil Bouzid, Kye Yeop Kim, et al.Physical Chemistry Chemical Physics : PCCP|March 30, 2017
Thermal conductivity of glassy GeTe<sub>4</sub> by first-principles molecular dynamicsAssil Bouzid, Hayat Zaoui, Pier Luca Palla, et al.Dalton Transactions (Cambridge, England : 2003)|March 8, 2024
Downshift of the Ni d band center over Ni nanoparticles <i>in situ</i> confined within an amorphous silicon nitride matrixNorifumi Asakuma, Shotaro Tada, Tomoyuki Tamura, et al.Physical Chemistry Chemical Physics : PCCP|July 1, 2026
First-principles modeling of polysilazane-derived SiCNH ceramics: insights into the organization of the free-carbon phaseFabien Mortier, Sylvian Cadars, Marwan Ben Miled, et al.Journal of Physics. Condensed Matter : an Institute of Physics Journal|December 29, 2023
Defect engineering of 1T'<i>MX</i><sub>2</sub>(<i>M</i>= Mo, W and<i>X</i>= S, Se) transition metal dichalcogenide-based electrocatalyst for alkaline hydrogen evolution reactionSamuel Akinlolu Ogunkunle, Assil Bouzid, Jack Jon Hinsch, et al.Pageof 3