Thermal expansion and recrystallization of amorphous Al and Ti: A molecular dynamics study

JJ Chu, CA Steeves - Journal of non-crystalline solids, 2011 - Elsevier
In this study, the thermal expansion and recrystallization behavior of amorphous Al and Ti
are investigated using molecular dynamics simulations. Amorphous phases are obtained via …

Pressure effect on the structural properties of amorphous Ag during isothermal annealing

FA Celik, S Kazanc, AK Yildiz, S Ozgen - Intermetallics, 2008 - Elsevier
In this study, using molecular dynamics (MD) simulations we investigate the effect of
pressure on the transformation from amorphous structure to crystalline structure during …

Investigation of bond orientational order of new Schiff base and theoretical study on Covid-19 activity: A molecular dynamics based on DFT and molecular docking …

A Yildirim, FA Celik, M Çıbuk, E Yilmaz - Chemical Physics Letters, 2022 - Elsevier
Abstract 2-(2-(3-hydroxy-4-methoxyphenyl) ethylidene) hydrazinecarbothioamide (HMHT)
and 2-(2-(4-ethoxy-3-methoxyphenyl) ethylidene) hydrazinecarbothioamide (EMHT) …

Pressure effect on intermediate structures during transition from amorphous to crystalline states of copper

S Kazanc, FA Celik, AK Yildiz, S Ozgen - Computational materials science, 2007 - Elsevier
This study presents a molecular dynamics simulation to investigate the pressure effect on
the rapid and slow solidification of Cu in liquid state within Sutton–Chen type of the …

Pressure effect on the icosahedral order of Pd50Si50 alloy: A molecular dynamics study

FA Celik, A Yildiz - Materials Today Communications, 2020 - Elsevier
Molecular dynamics (MD) simulation based on Quantum Embedded Atom Method (EAM)
has been used to determine the effect of pressure on icosahedral (icos) order of Pd 50 Si 50 …

A triaxial tensile deformation-induced nanoporous structure of aluminium: estimation of surface area, solid volume, and dimensionless aspect ratio

S Kumar, SK Das - Physical Chemistry Chemical Physics, 2017 - pubs.rsc.org
Nanoporous aluminium has great importance for large scale production of automobile and
aerospace spare parts due to its lightweight and non-corrosive nature. It is also suitable for …

Microstructural and Electronic Properties of the YSZ/CeO2 Interface via Multiscale Modeling

KK Ghuman, E Gilardi, D Pergolesi… - The Journal of …, 2020 - ACS Publications
There has been significant interest in the bilayer system formed by ceria (CeO2) and yttria-
stabilized zirconia (YSZ). Multiple studies have explored these two materials individually; …

Geçiş metali alaşımlarında amorf yapıdan kristal yapıya dönüşümün moleküler dinamik yöntemi ile incelenmesi

FA Çelik - 2010 - acikbilim.yok.gov.tr
Bu çalışmada, Cu ve Ni mono-atomik sistemleri, CuNi, NiAl ikili alaşım sistemleri ve CuAlNi
üçlü alaşım sistemi için atomlararası etkileşimler gömülmüş atom metodunun Sutton-Chen …

Nano yapılı geçiş metallerinde katı-sıvı faz dönüşümlerinin moleküler dinamik benzetimi

Ö Öztürk - acikbilim.yok.gov.tr
Bu tez çalışmasında, EAM üzerine kurulu MD benzetim yöntemi kullanılarak hacimli ve nano
yapılı Cu, Ni ve Au geçiş metallerinin katı-sıvı ve sıvı-katı faz dönüşümleri incelenmiştir …

[图书][B] Topics in Designing Low Thermal Expansion Lattices at the Microscale

J Chu - 2011 - library-archives.canada.ca
Abstract<? Pub Inc> Microscale bi-material lattices with near zero thermal expansion are
designed to create a thermally stable optical surface for applications in a space telescope …