@article{YangBudarapuMahapatraetal., author = {Yang, Shih-Wei and Budarapu, Pattabhi Ramaiah and Mahapatra, D.R. and Bordas, St{\´e}phane Pierre Alain and Zi, Goangseup and Rabczuk, Timon}, title = {A Meshless Adaptive Multiscale Method for Fracture}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {382 -- 395}, abstract = {A Meshless Adaptive Multiscale Method for Fracture}, subject = {Angewandte Mathematik}, language = {en} } @article{JiaZhangRabczuk, author = {Jia, Yue and Zhang, Yongjie and Rabczuk, Timon}, title = {A Novel Dynamic Multilevel Technique for Image Registration}, series = {Computers and Mathematics with Applications}, journal = {Computers and Mathematics with Applications}, abstract = {A Novel Dynamic Multilevel Technique for Image Registration}, subject = {Angewandte Mathematik}, language = {en} } @article{AreiasRabczukCesardeSaetal., author = {Areias, Pedro and Rabczuk, Timon and Cesar de Sa, J.M. and Jorge, R.N.}, title = {A semi-implicit _nite strain shell algorithm using in-plane strains based on least-squares}, series = {Computational Mechanics}, journal = {Computational Mechanics}, abstract = {A semi-implicit _nite strain shell algorithm using in-plane strains based on least-squares}, subject = {Angewandte Mathematik}, language = {en} } @article{JiangRabczukPark, author = {Jiang, Jin-Wu and Rabczuk, Timon and Park, Harold S.}, title = {A Stillinger-Weber Potential for Single-Layer Black Phosphorus, and the Importance of Cross-Pucker Interactions for Negative Poisson's Ratio and Edge Stress-Induced Bending}, series = {Nanoscale}, journal = {Nanoscale}, doi = {10.1039/C4NR07341J}, abstract = {The distinguishing structural feature of single-layered black phosphorus is its puckered structure, which leads to many novel physical properties. In this work, we first present a new parameterization of the Stillinger-Weber potential for single-layered black phosphorus. In doing so, we reveal the importance of a cross-pucker interaction term in capturing its unique mechanical properties, such as a negative Poisson's ratio. In particular, we show that the cross-pucker interaction enables the pucker to act as a re-entrant hinge, which expands in the lateral direction when it is stretched in the longitudinal direction. As a consequence, single-layered black phosphorus has a negative Poisson's ratio in the direction perpendicular to the atomic plane. As an additional demonstration of the impact of the cross-pucker interaction, we show that it is also the key factor that enables capturing the edge stress-induced bending of single-layered black phosphorus that has been reported in ab initio calculations.}, subject = {Angewandte Mathematik}, language = {en} } @article{SilaniTalebiZiaeiRadetal., author = {Silani, Mohammad and Talebi, Hossein and Ziaei-Rad, S. and Hamouda, A.M.S. and Zi, Goangseup and Rabczuk, Timon}, title = {A three dimensional Extended Arlequin Method for Dynamic Fracture}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {425 -- 431}, abstract = {A three dimensional Extended Arlequin Method for Dynamic Fracture}, subject = {Angewandte Mathematik}, language = {en} } @article{VuBacSilaniLahmeretal., author = {Vu-Bac, N. and Silani, Mohammad and Lahmer, Tom and Zhuang, Xiaoying and Rabczuk, Timon}, title = {A unified framework for stochastic predictions of Young's modulus of clay/epoxy nanocomposites (PCNs)}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {520 -- 535}, abstract = {A unified framework for stochastic predictions of Young's modulus of clay/epoxy nanocomposites (PCNs)}, subject = {Angewandte Mathematik}, language = {en} } @article{MsekhSargadoJamshidianetal., author = {Msekh, Mohammed Abdulrazzak and Sargado, M. and Jamshidian, M. and Areias, Pedro and Rabczuk, Timon}, title = {ABAQUS implementation of phase_field model for brittle fracture}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {472 -- 484}, abstract = {ABAQUS implementation of phase_field model for brittle fracture}, subject = {Angewandte Mathematik}, language = {en} } @phdthesis{Budarapu, author = {Budarapu, Pattabhi Ramaiah}, title = {Adaptive multiscale methods for fracture}, doi = {10.25643/bauhaus-universitaet.2391}, url = {http://nbn-resolving.de/urn:nbn:de:gbv:wim2-20150507-23918}, school = {Bauhaus-Universit{\"a}t Weimar}, abstract = {One major research focus in the Material Science and Engineering Community in the past decade has been to obtain a more fundamental understanding on the phenomenon 'material failure'. Such an understanding is critical for engineers and scientists developing new materials with higher strength and toughness, developing robust designs against failure, or for those concerned with an accurate estimate of a component's design life. Defects like cracks and dislocations evolve at nano scales and influence the macroscopic properties such as strength, toughness and ductility of a material. In engineering applications, the global response of the system is often governed by the behaviour at the smaller length scales. Hence, the sub-scale behaviour must be computed accurately for good predictions of the full scale behaviour. Molecular Dynamics (MD) simulations promise to reveal the fundamental mechanics of material failure by modeling the atom to atom interactions. Since the atomistic dimensions are of the order of Angstroms ( A), approximately 85 billion atoms are required to model a 1 micro- m^3 volume of Copper. Therefore, pure atomistic models are prohibitively expensive with everyday engineering computations involving macroscopic cracks and shear bands, which are much larger than the atomistic length and time scales. To reduce the computational effort, multiscale methods are required, which are able to couple a continuum description of the structure with an atomistic description. In such paradigms, cracks and dislocations are explicitly modeled at the atomistic scale, whilst a self-consistent continuum model elsewhere. Many multiscale methods for fracture are developed for "fictitious" materials based on "simple" potentials such as the Lennard-Jones potential. Moreover, multiscale methods for evolving cracks are rare. Efficient methods to coarse grain the fine scale defects are missing. However, the existing multiscale methods for fracture do not adaptively adjust the fine scale domain as the crack propagates. Most methods, therefore only "enlarge" the fine scale domain and therefore drastically increase computational cost. Adaptive adjustment requires the fine scale domain to be refined and coarsened. One of the major difficulties in multiscale methods for fracture is to up-scale fracture related material information from the fine scale to the coarse scale, in particular for complex crack problems. Most of the existing approaches therefore were applied to examples with comparatively few macroscopic cracks. Key contributions The bridging scale method is enhanced using the phantom node method so that cracks can be modeled at the coarse scale. To ensure self-consistency in the bulk, a virtual atom cluster is devised providing the response of the intact material at the coarse scale. A molecular statics model is employed in the fine scale where crack propagation is modeled by naturally breaking the bonds. The fine scale and coarse scale models are coupled by enforcing the displacement boundary conditions on the ghost atoms. An energy criterion is used to detect the crack tip location. Adaptive refinement and coarsening schemes are developed and implemented during the crack propagation. The results were observed to be in excellent agreement with the pure atomistic simulations. The developed multiscale method is one of the first adaptive multiscale method for fracture. A robust and simple three dimensional coarse graining technique to convert a given atomistic region into an equivalent coarse region, in the context of multiscale fracture has been developed. The developed method is the first of its kind. The developed coarse graining technique can be applied to identify and upscale the defects like: cracks, dislocations and shear bands. The current method has been applied to estimate the equivalent coarse scale models of several complex fracture patterns arrived from the pure atomistic simulations. The upscaled fracture pattern agree well with the actual fracture pattern. The error in the potential energy of the pure atomistic and the coarse grained model was observed to be acceptable. A first novel meshless adaptive multiscale method for fracture has been developed. The phantom node method is replaced by a meshless differential reproducing kernel particle method. The differential reproducing kernel particle method is comparatively more expensive but allows for a more "natural" coupling between the two scales due to the meshless interpolation functions. The higher order continuity is also beneficial. The centro symmetry parameter is used to detect the crack tip location. The developed multiscale method is employed to study the complex crack propagation. Results based on the meshless adaptive multiscale method were observed to be in excellent agreement with the pure atomistic simulations. The developed multiscale methods are applied to study the fracture in practical materials like Graphene and Graphene on Silicon surface. The bond stretching and the bond reorientation were observed to be the net mechanisms of the crack growth in Graphene. The influence of time step on the crack propagation was studied using two different time steps. Pure atomistic simulations of fracture in Graphene on Silicon surface are presented. Details of the three dimensional multiscale method to study the fracture in Graphene on Silicon surface are discussed.}, subject = {Material}, language = {en} } @article{NguyenThanhValizadehNguyenetal., author = {Nguyen-Thanh, Nhon and Valizadeh, Navid and Nguyen, Manh Hung and Nguyen-Xuan, Hung and Zhuang, Xiaoying and Areias, Pedro and Zi, Goangseup and Bazilevs, Yuri and De Lorenzis, Laura and Rabczuk, Timon}, title = {An extended isogeometric thin shell analysis based on Kirchhoff-Love theory}, series = {Computer Methods in Applied Mechanics and Engineering}, journal = {Computer Methods in Applied Mechanics and Engineering}, pages = {265 -- 291}, abstract = {An extended isogeometric thin shell analysis based on Kirchho_-Love theory}, subject = {Angewandte Mathematik}, language = {en} } @article{AnitescuJiaZhangetal., author = {Anitescu, Cosmin and Jia, Yue and Zhang, Yongjie and Rabczuk, Timon}, title = {An isogeometric collocation method using superconvergent points}, series = {Computer Methods in Applied Mechanics and Engineer-ing}, journal = {Computer Methods in Applied Mechanics and Engineer-ing}, pages = {1073 -- 1097}, abstract = {An isogeometric collocation method using superconvergent points}, subject = {Angewandte Mathematik}, language = {en} } @article{RabizadehSaboorBagherzadehRabczuk, author = {Rabizadeh, Ehsan and Saboor Bagherzadeh, Amir and Rabczuk, Timon}, title = {Application of goal-oriented error estimation and adaptive mesh refinement on thermo-mechanical multifield problems}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {27 -- 44}, abstract = {Application of goal-oriented error estimation and adaptive mesh re_nement on thermo-mechanical multi_eld problems}, subject = {Angewandte Mathematik}, language = {en} } @article{ZhaoJiaWeietal., author = {Zhao, Jun-Hua and Jia, Yue and Wei, Ning and Rabczuk, Timon}, title = {Binding energy and mechanical stability of two parallel and crossing carbon nanotubes}, series = {Journal of Applied Mechanics}, journal = {Journal of Applied Mechanics}, abstract = {Binding energy and mechanical stability of two parallel and crossing carbon nanotubes}, subject = {Angewandte Mathematik}, language = {en} } @article{TalebiSilaniRabczuk, author = {Talebi, Hossein and Silani, Mohammad and Rabczuk, Timon}, title = {Concurrent Multiscale Modelling of Three Dimensional Crack and Dislocation Propagation}, series = {Advances in Engineering Software}, journal = {Advances in Engineering Software}, pages = {82 -- 92}, abstract = {Concurrent Multiscale Modelling of Three Dimensional Crack and Dislocation Propagation}, subject = {Angewandte Mathematik}, language = {en} } @article{ZhaoLuZhangetal., author = {Zhao, Jun-Hua and Lu, Lixin and Zhang, Zhiliang and Guo, Wanlin and Rabczuk, Timon}, title = {Continuum modeling of the cohesive energy for the interfaces between _lms, spheres, coats and substrates}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {432 -- 438}, abstract = {Continuum modeling of the cohesive energy for the interfaces between _lms, spheres, coats and substrates}, subject = {Angewandte Mathematik}, language = {en} } @article{AreiasRabczukQueirosdeMeloetal., author = {Areias, Pedro and Rabczuk, Timon and Queiros de Melo, F. J. M. and Cesar de Sa, J.M.}, title = {Coulomb frictional contact by explicit projection in the cone for _nite displacement quasi-static problems}, series = {Computational Mechanics}, journal = {Computational Mechanics}, pages = {57 -- 72}, abstract = {Coulomb frictional contact by explicit projection in the cone for _nite displacement quasi-static problems}, subject = {Angewandte Mathematik}, language = {en} } @article{NanthakumarLahmerZhuangetal., author = {Nanthakumar, S.S. and Lahmer, Tom and Zhuang, Xiaoying and Zi, Goangseup and Rabczuk, Timon}, title = {Detection of material interfaces using a regularized level set method in piezoelectric structures}, series = {Inverse Problems in Science and Engineering}, journal = {Inverse Problems in Science and Engineering}, abstract = {Detection of material interfaces using a regularized level set method in piezoelectric structures}, subject = {Angewandte Mathematik}, language = {en} } @article{BudarapuNarayanaRammohanetal., author = {Budarapu, Pattabhi Ramaiah and Narayana, T.S.S. and Rammohan, B. and Rabczuk, Timon}, title = {Directionality of sound radiation from rectangular panels}, series = {Applied Acoustics}, journal = {Applied Acoustics}, pages = {128 -- 140}, abstract = {Directionality of sound radiation from rectangular panels}, subject = {Angewandte Mathematik}, language = {en} } @article{AreiasRabczukCesardeSaetal., author = {Areias, Pedro and Rabczuk, Timon and Cesar de Sa, J.M. and Garcao, J.E.}, title = {Finite strain quadrilateral shell using least-squares _t of relative Lagrangian in-plane strains}, series = {Finite Elements in Analysis and Design}, journal = {Finite Elements in Analysis and Design}, pages = {26 -- 40}, abstract = {Finite strain quadrilateral shell using least-squares _t of relative Lagrangian in-plane strains}, subject = {Angewandte Mathematik}, language = {en} } @article{GhasemiKerfridenBordasetal., author = {Ghasemi, Hamid and Kerfriden, Pierre and Bordas, St{\´e}phane Pierre Alain and Muthu, Jacob and Zi, Goangseup and Rabczuk, Timon}, title = {Interfacial shear stress optimization in sandwich beams with polymeric core using nonuniform distribution of reinforcing ingredients}, series = {Composite Structures}, journal = {Composite Structures}, pages = {221 -- 230}, abstract = {Interfacial shear stress optimization in sandwich beams with polymeric core using nonuniform distribution of reinforcing ingredients}, subject = {Angewandte Mathematik}, language = {en} } @article{ThaiNguyenXuanBordasetal., author = {Thai, Chien H. and Nguyen-Xuan, Hung and Bordas, St{\´e}phane Pierre Alain and Nguyen-Thanh, Nhon and Rabczuk, Timon}, title = {Isogeometric analysis of laminated composite plates using the higher-order shear deformation theory}, series = {Mechanics of Advanced Materials and Structures}, journal = {Mechanics of Advanced Materials and Structures}, pages = {451 -- 469}, abstract = {Isogeometric analysis of laminated composite plates using the higher-order shear deformation theory}, subject = {Angewandte Mathematik}, language = {en} } @article{MortazaviCunibertiRabczuk, author = {Mortazavi, Bohayra and Cuniberti, G. and Rabczuk, Timon}, title = {Mechanical properties and thermal conductivity of graphitic carbon nitride: A molecular dynamics study}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {285 -- 289}, abstract = {Mechanical properties and thermal conductivity of graphitic carbon nitride: A molecular dynamics study}, subject = {Angewandte Mathematik}, language = {en} } @article{KumarSinghMishraetal., author = {Kumar, S. and Singh, I. and Mishra, B.K. and Rabczuk, Timon}, title = {Modeling and Simulation of Kinked Cracks by Virtual Node XFEM}, series = {Computer Methods in Applied Mechanics and Engineering}, journal = {Computer Methods in Applied Mechanics and Engineering}, pages = {1425 -- 1466}, abstract = {Modeling and Simulation of Kinked Cracks by Virtual Node XFEM}, subject = {Angewandte Mathematik}, language = {en} } @article{MortazaviRabczuk, author = {Mortazavi, Bohayra and Rabczuk, Timon}, title = {Multiscale modeling of heat conduction in graphene laminates}, series = {Carbon}, journal = {Carbon}, pages = {1 -- 7}, abstract = {Multiscale modeling of heat conduction in graphene laminates}, subject = {Angewandte Mathematik}, language = {en} } @article{ArashRabczukJiang, author = {Arash, Behrouz and Rabczuk, Timon and Jiang, Jin-Wu}, title = {Nanoresonators and their applications: a state of the art review}, series = {Applied Physics Reviews}, journal = {Applied Physics Reviews}, abstract = {Nanoresonators and their applications: a state of the art review}, subject = {Angewandte Mathematik}, language = {en} } @article{GhasemiBrighentiZhuangetal., author = {Ghasemi, Hamid and Brighenti, Roberto and Zhuang, Xiaoying and Muthu, Jacob and Rabczuk, Timon}, title = {Optimum fiber content and distribution in fiber-reinforced solids using a reliability and NURBS based sequential optimization approach}, series = {Structural and Multidisciplinary Optimization}, journal = {Structural and Multidisciplinary Optimization}, pages = {99 -- 112}, abstract = {Optimum _ber content and distribution in _ber-reinforced solids using a reliability and NURBS based sequential optimization approach}, subject = {Angewandte Mathematik}, language = {en} } @article{HamdiaLahmerNguyenThoietal., author = {Hamdia, Khader and Lahmer, Tom and Nguyen-Thoi, T. and Rabczuk, Timon}, title = {Predicting The Fracture Toughness of PNCs: A Stochastic Approach Based on ANN and ANFIS}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {304 -- 313}, abstract = {Predicting The Fracture Toughness of PNCs: A Stochastic Approach Based on ANN and ANFIS}, subject = {Angewandte Mathematik}, language = {en} } @article{GhorashiValizadehMohammadietal., author = {Ghorashi, Seyed Shahram and Valizadeh, Navid and Mohammadi, S. and Rabczuk, Timon}, title = {T-spline based XIGA for Fracture Analysis of Orthotropic Media}, series = {Computers \& Structures}, journal = {Computers \& Structures}, pages = {138 -- 146}, abstract = {T-spline based XIGA for Fracture Analysis of Orthotropic Media}, subject = {Angewandte Mathematik}, language = {en} } @article{BenZhaoZhangetal., author = {Ben, S. and Zhao, Jun-Hua and Zhang, Yancheng and Rabczuk, Timon}, title = {The interface strength and debonding for composite structures: review and recent developments}, series = {Composite Structures}, journal = {Composite Structures}, abstract = {The interface strength and debonding for composite structures: review and recent developments}, subject = {Angewandte Mathematik}, language = {en} } @article{ZhaoLuRabczuk, author = {Zhao, Jiyun and Lu, Lixin and Rabczuk, Timon}, title = {The tensile and shear failure behavior dependence on chain length and temperature in amorphous polymers}, series = {Computational Materials Science}, journal = {Computational Materials Science}, pages = {567 -- 572}, abstract = {The tensile and shear failure behavior dependence on chain length and temperature in amorphous polymers}, subject = {Angewandte Mathematik}, language = {en} } @article{VuBacRafieeZhuangetal., author = {Vu-Bac, N. and Rafiee, Roham and Zhuang, Xiaoying and Lahmer, Tom and Rabczuk, Timon}, title = {Uncertainty quantification for multiscale modeling of polymer nanocomposites with correlated parameters}, series = {Composites Part B: Engineering}, journal = {Composites Part B: Engineering}, pages = {446 -- 464}, abstract = {Uncertainty quantification for multiscale modeling of polymer nanocomposites with correlated parameters}, subject = {Angewandte Mathematik}, language = {en} } @article{LahmerIlgLerch, author = {Lahmer, Tom and Ilg, J. and Lerch, Reinhard}, title = {Variance-based sensitivity analyses of piezoelectric models}, series = {Computer Modeling in Engineering \& Sciences}, journal = {Computer Modeling in Engineering \& Sciences}, pages = {105 -- 126}, abstract = {Variance-based sensitivity analyses of piezoelectric models}, subject = {Angewandte Mathematik}, language = {en} }