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Multiscale simulation approach to investigate the binder distribution in...

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March 8, 2022, 4:00 pm

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Effect of pulse laser frequency on PLD growth of LuFeO3 explained by kinetic...

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April 4, 2022, 5:00 pm

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Cationic vacancies as defects in honeycomb lattices with modular symmetries

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April 18, 2022, 5:00 pm

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Atomistic and machine learning studies of solute segregation in metastable...

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April 22, 2022, 5:00 pm

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Topology dependence of skyrmion Seebeck and skyrmion Nernst effect

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April 25, 2022, 5:00 pm

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Brønsted acidity in zeolites measured by deprotonation energy

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May 3, 2022, 5:00 pm

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Octahedral oxide glass network in ambient pressure neodymium titanate

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May 17, 2022, 5:00 pm

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Atomistic weak interaction criterion for the specificity of liquid metal...

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July 3, 2022, 5:00 pm

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Solid-state bonding behavior between surface-nanostructured Cu and Au: a...

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July 25, 2022, 5:00 pm

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Molecular dynamics analysis of elastic properties and new phase formation...

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August 2, 2022, 5:00 pm

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MISPR: an open-source package for high-throughput multiscale molecular...

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September 20, 2022, 5:00 pm

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Investigation of the effect of fly ash content on the bonding performance of...

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October 18, 2022, 5:00 pm

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In silico study on probing atomistic insights into structural stability and...

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November 28, 2022, 4:00 pm

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Energetic and atomic structural analyses of the screw dislocation absorption...

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December 8, 2022, 4:00 pm

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Mechanical and gas adsorption properties of graphene and graphynes under...

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December 26, 2022, 4:00 pm

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Addressing diffusion behavior and impact in an epoxy–amine cure system using...

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January 3, 2023, 4:00 pm

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Cu3Sn joint based on transient liquid phase bonding of Cu@Cu6Sn5 core–shell...

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January 11, 2023, 4:00 pm

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Magnetization dynamics at finite temperature in CoFeB–MgO based MTJs

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February 13, 2023, 4:00 pm

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Charge-optimized many-body interaction potential for AlN revisited to explore...

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March 30, 2023, 5:00 pm

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Impact of d-states on transition metal impurity diffusion in TiN

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May 21, 2023, 5:00 pm

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First-principles demonstration of band filling-induced significant...

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June 27, 2023, 5:00 pm

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Interface microstructure effects on dynamic failure behavior of layered Cu/Ta...

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July 12, 2023, 5:00 pm

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Simulations of magnetization reversal in FM/AFM bilayers with THz frequency...

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July 27, 2023, 5:00 pm

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Predicting elastic and plastic properties of small iron polycrystals by...

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August 25, 2023, 5:00 pm

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Atomistic insights into adhesion characteristics of tungsten on titanium...

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October 9, 2023, 5:00 pm

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Ab initio structural dynamics of pure and nitrogen-containing amorphous carbon

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November 10, 2023, 4:00 pm

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Machine learning and atomistic origin of high dielectric permittivity in oxides

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December 13, 2023, 4:00 pm

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First principles-based design of lightweight high entropy alloys

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December 17, 2023, 4:00 pm

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Impact of crystalline orientation on Cu–Cu solid-state bonding behavior by...

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December 26, 2023, 4:00 pm

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Rapid and accurate predictions of perfect and defective material properties...

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January 1, 2024, 4:00 pm

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