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Comparative investigation of a newly optimized modified embedded atom method potential with other potentials for silicon

JOURNAL ARTICLE published November 2015 in Computational Materials Science

Research funded by National Natural Science Foundation of China (51175503) | Doctoral Innovation Foundation of NUDT (B140305)

Authors: Bin Liu | Hao Zhang | Junyong Tao | Xun Chen | Yun’an Zhang

https://doi.org/10.1016/j.commatsci.2015.07.040 Actions

Simulated rhythmic growth of targeted single crystal by polymer phase-field model

JOURNAL ARTICLE published February 2013 in Computational Materials Science

Authors: D. Wang | Z.K. Jin | Y. Xing | H. Gao | X.K. Wang

https://doi.org/10.1016/j.commatsci.2012.08.016 Actions

Numerical simulations and modeling of the stability of noble gas atoms in interaction with vacancies in silicon

JOURNAL ARTICLE published December 2014 in Computational Materials Science

Authors: L. Pizzagalli | A. Charaf-Eddin | S. Brochard

https://doi.org/10.1016/j.commatsci.2014.07.011 Actions

Indentation creep surface morphology of nickel-based single crystal superalloys

JOURNAL ARTICLE published August 2009 in Computational Materials Science

Authors: Baoxing Xu | Akio Yonezu | Zhufeng Yue | Xi Chen

https://doi.org/10.1016/j.commatsci.2009.03.004 Actions

Effect of piezoelectricity on critical thickness for misfit dislocation formation at InGaN/GaN interface

JOURNAL ARTICLE published February 2015 in Computational Materials Science

Authors: D. Mishra | Y.-H. Cho | M.-B. Shim | S. Hwang | S. Kim | C.Y. Park | S.Y. Seo | S.-H. Yoo | S.-H. Park | Y.E. Pak

https://doi.org/10.1016/j.commatsci.2014.10.015 Actions

A hybrid approach to design materials with negative linear compressibility

JOURNAL ARTICLE published November 2013 in Computational Materials Science

Authors: Asaad Faramarzi | Amir M. Alani | Ouahid Harireche

https://doi.org/10.1016/j.commatsci.2013.08.007 Actions

Fast crack kinking manipulated by atomic hoop stress in monolayer hexagonal boron nitride strip

JOURNAL ARTICLE published November 2018 in Computational Materials Science

Research funded by NSFC (11372131) | Natural Science Foundation of Jiangsu Province of China (BK20161483) | Aeronautical Science Foundation (2016ZF52063) | Foundations of State Key Laboratory of Mechanics and Control of Mechanical Structures (MCMS-0216G01,MCMS-0217 K01)

Authors: Hanqi Zhang | Bin Zhang

https://doi.org/10.1016/j.commatsci.2018.07.029 Actions

Numerical analysis of the beneficial effect of the double symmetric patch repair compared to single one in aircraft structures

JOURNAL ARTICLE published February 2007 in Computational Materials Science

Authors: B. Bachir Bouiadjra | H. Fekirini | B. Serier | M. Benguediab

https://doi.org/10.1016/j.commatsci.2006.05.020 Actions

The effect of local ordering on the structure phase transition in disordered KTa1/2Nb1/2O3 from first principles studies

JOURNAL ARTICLE published May 2008 in Computational Materials Science

Authors: Yanqing Shen | Zhongxiang Zhou

https://doi.org/10.1016/j.commatsci.2007.08.004 Actions

Grain size effects on indentation-induced defect evolution and plastic deformation mechanism of ploycrystalline materials

JOURNAL ARTICLE published December 2018 in Computational Materials Science

Research funded by National Natural Science Foundation of China (51775146) | State Key Program of National Natural Science Foundation of China (51535003)

Authors: Pengyue Zhao | Yongbo Guo

https://doi.org/10.1016/j.commatsci.2018.09.014 Actions

Understanding the metallic glasses formation by applying a centrality measure based on betweenness

JOURNAL ARTICLE published February 2023 in Computational Materials Science

Research funded by Government of Spain Ministry of Science, Innovation and Universities (PID2020-112827GB-I00)

Authors: Rocío Rodríguez | Manuel Curado | Leandro Tortosa | Jose F. Vicent

https://doi.org/10.1016/j.commatsci.2022.111986 Actions

Strain-driven phase transition of molybdenum nanowire under uniaxial tensile strain

JOURNAL ARTICLE published December 2010 in Computational Materials Science

Authors: Jiaming Wang | Wangyu Hu | Xiaofan Li | Shifang Xiao | Huiqiu Deng

https://doi.org/10.1016/j.commatsci.2010.08.029 Actions

Size-dependent surface energy density of typically fcc metallic nanomaterials

JOURNAL ARTICLE published February 2014 in Computational Materials Science

Research funded by NSFC (11125211,11021262)

Authors: Cun Zhang | Yin Yao | Shaohua Chen

https://doi.org/10.1016/j.commatsci.2013.10.015 Actions

Optimization of strain field distribution for generation of compound curve surfaces using line heating technique

JOURNAL ARTICLE published March 2009 in Computational Materials Science

Authors: Pankaj Biswas | N.R. Mandal | O.P. Sha

https://doi.org/10.1016/j.commatsci.2008.03.049 Actions

A two-scale model for predicting elastic properties of porous titanium formed with space-holders

JOURNAL ARTICLE published November 2010 in Computational Materials Science

Authors: Wenjuan Niu | Simon Gill | Hongbiao Dong | Chenguang Bai

https://doi.org/10.1016/j.commatsci.2010.07.022 Actions

Electronic structure and optical transition in heavy metal doped ZnO by first-principle calculations

JOURNAL ARTICLE published March 2012 in Computational Materials Science

Authors: X.D. Zhang | M.L. Guo | Y.Y. Shen | C.L. Liu | Y.H. Xue | F. Zhu | L.H. Zhang

https://doi.org/10.1016/j.commatsci.2011.10.003 Actions

Force field for realistic molecular dynamics simulations of TiO 2 growth

JOURNAL ARTICLE published June 2017 in Computational Materials Science

Research funded by Grant Agency of the Czech Republic (15-00859Y) | National Grid Infrastructure MetaCentrum (Czech Republic) (LM2015042)

Authors: Jiri Houska

https://doi.org/10.1016/j.commatsci.2017.03.024 Actions

Investigation of structural, magnetic and electronic properties of CoMnSb superstructure: A DFT study

JOURNAL ARTICLE published July 2022 in Computational Materials Science

Authors: Madhusmita Baral | Tapas Ganguli | Aparna Chakrabarti

https://doi.org/10.1016/j.commatsci.2022.111441 Actions

Parametric study of multiphase TRIP steels undergoing cyclic loading

JOURNAL ARTICLE published February 2011 in Computational Materials Science

Authors: D.D. Tjahjanto | A.S.J. Suiker | S. Turteltaub | S. van der Zwaag

https://doi.org/10.1016/j.commatsci.2010.12.004 Actions

A complex variable solution of two-dimensional heat conduction of composites reinforced with periodic arrays of cylindrically orthotropic fibers

JOURNAL ARTICLE published December 2010 in Computational Materials Science

Authors: P. Yan | C.P. Jiang | F. Song

https://doi.org/10.1016/j.commatsci.2010.09.037 Actions
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