Computational Materials Science

Title Publication Date Language Citations
First principles study on the elastic properties and electronic structures of (Fe, Cr)3C2009/06/01English55
Effective properties for sandwich plates with aluminium foil honeycomb core and polymer foam filling – Static and dynamic response2011/02/01English55
Numerical study on deformation behaviors of thin-walled tube NC bending with large diameter and small bending radius2009/06/01English55
Electronic properties of nano-graphene sheets calculated using quantum chemical DFT2008/11/01English55
Structural, elastic, electronic and thermodynamic properties of KTaO3 and NaTaO3: Ab initio investigations2013/07/01English55
A constitutive model for modeling of the deformation behavior in microforming with a consideration of grain boundary strengthening2012/04/01English54
Nonlocal beam model for nonlinear analysis of carbon nanotubes on elastomeric substrates2011/01/01English54
Discrete element modeling of the microbond test of fiber reinforced composite2010/08/01English54
A numerical study into the effects of elongated capsules on the healing efficiency of liquid-based systems2009/12/01English54
A modified Tersoff potential for pure and hydrogenated diamond-like carbon2013/02/01English54
First-principles computation of material properties: the ABINIT software project2002/11/01English54
AQUAMI: An open source Python package and GUI for the automatic quantitative analysis of morphologically complex multiphase materials2017/11/01English54
Micromechanical investigations of arrangement effects in particle reinforced metal matrix composites1994/11/01English54
Molecular dynamics simulation of the alloying reaction in Al-coated Ni nanoparticle2010/01/01English54
Evolutionary design of generalized GMDH-type neural network for prediction of concrete compressive strength using UPV2010/09/01English54
A constitutive model of metal–ceramic functionally graded material behavior: Formulation and parameter identification2008/07/01English54
Numerical simulation of the effect of particle spatial distribution and strength on tensile behavior of particle reinforced composites2008/12/01English54
Effective elastic properties of interpenetrating phase composites2008/12/01English54
The electronic, magnetic and optical properties of double perovskite A2FeReO6 (A = Sr, Ba) from first principles approach2015/04/01English54
A method to quantitatively upscale the damage initiation of dual-phase steels under various stress states from microscale to macroscale2014/11/01English54
Numerical simulation of the non-linear deformation of 5-harness satin weaves2012/08/01English54
The electronic and optical properties of the fluoroperovskite BaXF3 (X=Li, Na, K, and Rb) compounds2012/06/01English54
A new method to predict the metadynamic recrystallization behavior in 2124 aluminum alloy2011/05/01English54
Characterization of ductile damage for a high carbon steel using 3D X-ray micro-tomography and mechanical tests – Application to the identification of a shear modified GTN model2014/03/01English54
3D coupled thermo-mechanical FE analysis of roll size effects on the radial–axial ring rolling process2011/01/01English54
First-principles study on the structural stability, electronic and magnetic properties of Fe2C2008/06/01English54
Cyclic viscoplasticity of high-density polyethylene: Experiments and modeling2007/04/01English54
Finite element formulation of a phase field model based on the concept of generalized stresses2009/05/01English54
Numerical implementation of imperfect interfaces2007/10/01English54
Modeling microstructural evolution in irradiated materials with cluster dynamics methods: A review2018/06/01English54