Computational materials science
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
Table of contents
- 3271
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Molecular dynamics potentials in magnetite (Fe3O4) modelingSoontrapa, C. / Chen, Y. et al. | 2011
- 3282
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Molecular dynamics simulation of a novel kind of polymer composite incorporated with polyhedral oligomeric silsesquioxane (POSS)Song, Xueyu / Sun, Yi / Wu, Xiaorong et al. | 2011
- 3290
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Surface energy calculation of bcc metals using the analytical equivalent crystal theory methodAghemenloh, E. / Umukoro, J.O. / Azi, S.O. et al. | 2011
- 3297
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First-principles study of ground state properties of ZrH2Zhang, Peng / Wang, Bao-Tian / He, Chao-Hui et al. | 2011
- 3303
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Structural, electronic, elastic and thermodynamic properties of AlSi2RE (RE=La, Ce, Pr and Nd) from first-principle calculationsMingjun, Pang / Zhan, Yongzhong / Haizhou, Wang et al. | 2011
- 3311
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Adsorption and dissociation of N2O molecule on Fe(111) surface: A DFT studyWu, Shiuan-Yau / Su, Chia-Hao / Chang, Jee-Gong et al. | 2011
- 3315
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Thermo-mechanical analysis of Wire and Arc Additive Layer Manufacturing process on large multi-layer partsDing, J. / Colegrove, P. / Mehnen, J. et al. | 2011
- 3323
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Two analytical models for the probability characteristics of a crack hitting encapsulated particles: Application to self-healing materialsZemskov, Serguey V. / Jonkers, Henk M. / Vermolen, Fred J. et al. | 2011
- 3334
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Three dimensional simulation of microstructure evolution for ceramic tool materialsHao, Song / Huang, Chuanzhen / Zou, Bin et al. | 2011
- 3342
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Surface effects on stacking fault and twin formation in fcc nanofilms: A first-principles studyDatta, A. / Srirangarajan, A. / Waghmare, U.V. et al. | 2011
- 3346
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Fast calculation approach to semi-empirical molecular orbital method using real space division methodIgarashi, Takahiro / Nakazawa, Tetsuya / Suzuki, Chikashi et al. | 2011
- 3350
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Modeling Charpy impact energy of functionally graded steel based on the strain gradient plasticity theory and modified stress–strain curve dataNazari, Ali et al. | 2011
- 3358
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An incremental damage theory for micropolar composites taking account of progressive debonding and particle size effectJiang, Yunpeng / Tohgo, Keiichiro et al. | 2011
- 3365
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Stochastic simulation model for the 3D morphology of composite materials in Li–ion batteriesThiedmann, Ralf / Stenzel, Ole / Spettl, Aaron et al. | 2011
- 3377
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Determination of volume fraction of bainite in low carbon steels using artificial neural networksSidhu, G. / Bhole, S.D. / Chen, D.L. et al. | 2011
- 3385
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Molecular dynamics simulation of the effect of surface roughness and pore on linear friction welding between Ni and AlJiao, Zhen / Song, Changbao / Lin, Tiesong et al. | 2011
- 3390
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Density functional study on the geometric features and growing pattern of AlnNm clusters (n =1–4, m =1–4, n + m ⩽5)Curotto, Verónica Ferraresi / Diez, Reinaldo Pis et al. | 2011
- 3397
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Hydrogen hardening effect in heavily deformed single crystal α-FeXie, Wenbo / Liu, Xiaoyang / Chen, Weixing et al. | 2011
- 3397
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Hydrogen hardening effect in heavily deformed single crystal a-FeXie, W. / Liu, X. / Chen, W. et al. | 2011
- 3403
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Strain gradient plasticity theory for modeling JIC of functionally graded steelsNazari, Ali et al. | 2011
- 3410
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Application of strain gradient plasticity theory to model Charpy impact energy of functionally graded steelsNazari, Ali et al. | 2011
- 3417
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Molecular dynamics study of the influence of functionalization on the elastic properties of single and multiwall carbon nanotubesCoto, Borja / Antia, Ibai / Blanco, Miren et al. | 2011
- 3425
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Numerical exploration of plastic deformation mechanisms of copper nanowires with surface defectsZhan, H.F. / Gu, Y.T. / Yan, C. et al. | 2011
- 3431
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Multiscale simulation of nanometric cutting of single crystal copper and its experimental validationPen, H.M. / Liang, Y.C. / Luo, X.C. et al. | 2011
- 3442
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Strain gradient plasticity theory to predict the input data for modeling Charpy impact energy in functionally graded steelsNazari, Ali et al. | 2011
- 3450
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FEM simulations of tensile deformation and fracture analysis for CuW alloys at mesoscopic levelYanlong, Wang / Shuhua, Liang / Peng, Xiao et al. | 2011
- IFC
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IFC| 2011