Kinetic Monte Carlo Method: Mathematical Foundations and Applications for Physics of Low-Dimensional Nanostructures
暂无分享,去创建一个
[1] S. Kolesnikov. Low-temperature study of the magnetic properties of finite atomic chains , 2016 .
[2] A. Saletsky,et al. Ab initio study of interaction between 3d adatoms on the vicinal Cu(111) surface , 2016 .
[3] A. Klavsyuk,et al. Fe and Co nanostructures embedded into the Cu(100) surface: Self-Organization and magnetic properties , 2015 .
[4] A. Saletsky,et al. Formation and properties of metallic atomic contacts , 2015 .
[5] A. Saletsky,et al. Magnetization dynamics of mixed Co–Au chains on Cu(110) substrate: Combined ab initio and kinetic Monte Carlo study , 2015 .
[6] J. M. Sellier,et al. An introduction to applied quantum mechanics in the Wigner Monte Carlo formalism , 2015 .
[7] Haixuan Xu,et al. Self-Evolving Atomistic Kinetic Monte Carlo Simulations of Defects in Materials , 2015 .
[8] D. Wolf,et al. Impurity-induced island pinning during electromigration , 2015 .
[9] S. C. Pieper,et al. Quantum Monte Carlo methods for nuclear physics , 2014, 1412.3081.
[10] Banggui Liu,et al. Monte Carlo simulated dynamical magnetization of single-chain magnets , 2014, 1403.3188.
[11] A. Syromyatnikov,et al. Analysis of interactions between Co adatoms on the vicinal Cu(111) surface , 2014 .
[12] Sadasivan Shankar,et al. Extended temperature-accelerated dynamics: enabling long-time full-scale modeling of large rare-event systems. , 2014, The Journal of chemical physics.
[13] S. Kolesnikov. Self-organization of iron-atom nanostructures in the first layer of the (100) copper surface , 2014 .
[14] D. Wolf,et al. Anisotropy of electromigration-induced void and island drift , 2014, Journal of physics. Condensed matter : an Institute of Physics journal.
[15] G. Blake,et al. DYNAMICS OF CO IN AMORPHOUS WATER-ICE ENVIRONMENTS , 2013, 1311.6643.
[16] G. Nandipati,et al. Kinetically driven shape changes in early stages of two-dimensional island coarsening: Ag/Ag(111) , 2013 .
[17] A. Saletsky,et al. Simulation of the self-organization of nanocontacts in thin gold films , 2013, Physics of the Solid State.
[18] G. Nandipati,et al. Self-diffusion of small Ni clusters on the Ni(111) surface: A self-learning kinetic Monte Carlo study , 2013 .
[19] O. V. Drozdov,et al. Influence of burrowing the atoms on the density of the Fe and Co nanoclusters on the Cu(100) surface , 2013 .
[20] A. Saletsky,et al. Self-organisation and magnetic properties of Co nanostructures embedded in a Cu(100) surface , 2013 .
[21] Kristen A Fichthorn,et al. A local superbasin kinetic Monte Carlo method. , 2013, The Journal of chemical physics.
[22] D. Wolf,et al. A three-dimensional self-learning kinetic Monte Carlo model: application to Ag(111) , 2012, Journal of physics. Condensed matter : an Institute of Physics journal.
[23] H. Jónsson,et al. Long-timescale simulations of diffusion in molecular solids. , 2012, Physical chemistry chemical physics : PCCP.
[24] D. Wolf,et al. Simulation of electromigration effects on voids in monocrystalline Ag films , 2012 .
[25] J. Kauttonen,et al. Single-layer metal-on-metal islands driven by strong time-dependent forces. , 2011, Physical review. E, Statistical, nonlinear, and soft matter physics.
[26] A. Saletsky,et al. Anisotropy of energy barriers for diffusion of the Co adatom in the vicinity of the Co islands on the Cu(100) surface , 2011 .
[27] R. Gastel,et al. Vacancy-mediated diffusion of Co atoms embedded in Cu(001) , 2011 .
[28] A. Klavsyuk,et al. Molecular dynamics simulation of the formation of metal nanocontacts , 2011 .
[29] R. Stoller,et al. Simulating complex atomistic processes: On-the-fly kinetic Monte Carlo scheme with selective active volumes , 2011 .
[30] T. Rahman,et al. The crossover from collective motion to periphery diffusion for two-dimensional adatom-islands on Cu(111) , 2011, Journal of physics. Condensed matter : an Institute of Physics journal.
[31] Normand Mousseau,et al. Kinetic activation-relaxation technique. , 2011, Physical review. E, Statistical, nonlinear, and soft matter physics.
[32] S. Takizawa,et al. On-the-Fly Kinetic Monte Carlo Simulation of Atomic Diffusion in L 1 0 Structure , 2011 .
[33] M. Troyer,et al. Continuous-time Monte Carlo methods for quantum impurity models , 2010, 1012.4474.
[34] J. M. Rogowska. Dilute nanostructures built of dimers: Kinetic Monte Carlo study of Co on Cu(111) , 2010 .
[35] Banggui Liu,et al. Dynamical ferromagnetism of interacting tiny magnets with strong anisotropy , 2010 .
[36] Krishna Garikipati,et al. An energy basin finding algorithm for kinetic Monte Carlo acceleration. , 2010, The Journal of chemical physics.
[37] A. Saletsky,et al. Vacancy formation on stepped Cu(100) accelerated with STM: Molecular dynamics and kinetic Monte Carlo simulations , 2009 .
[38] L. Niebergall,et al. Magnetic ordering of nanocluster ensembles promoted by electronic substrate-mediated interaction: Ab initio and kinetic Monte Carlo studies , 2009 .
[39] A. Klavsyuk,et al. Simulation of the formation of vacancies upon scanning of Cu(100) surface , 2009 .
[40] Sidney Yip,et al. Computing the viscosity of supercooled liquids. , 2009, The Journal of chemical physics.
[41] A. Klavsyuk,et al. Formation of cobalt bilayer islands on Cu(100) surface , 2009 .
[42] W. Hergert,et al. Magnetic behavior of one- and two-dimensional nanostructures stabilized by surface-state electrons: a kinetic Monte Carlo study , 2009 .
[43] Y. Pennec,et al. Effect of strain relaxations on heteroepitaxial metal-on-metal island nucleation and superlattice formation: Fe on Cu(111) , 2009 .
[44] A. Saletsky,et al. Atomic-scale self-organization of Co nanostructures embedded into Cu(100) , 2009 .
[45] Oleg Trushin,et al. Parallel kinetic Monte Carlo simulations of Ag(111) island coarsening using a large database , 2009, Journal of physics. Condensed matter : an Institute of Physics journal.
[46] M. Daw,et al. Calculations of diffusion in FCC binary alloys using on-the-fly kinetic Monte Carlo , 2008 .
[47] W. Hergert,et al. Effect of quantum confinement of surface electrons on an atomic motion on nanoislands , 2008, 0805.2281.
[48] K. Kern,et al. Bilayer growth of nanoscale Co islands on Cu(111) , 2008 .
[49] Clinton Dew Van Siclen,et al. Stochastic method for accommodation of equilibrating basins in kinetic Monte Carlo simulations , 2007, Journal of physics. Condensed matter : an Institute of Physics journal.
[50] J. M. Rogowska,et al. Dilute Cu nanostructure stabilized by substrate-mediated interactions on Cu(111) : Kinetic Monte Carlo simulations , 2006 .
[51] H. Fangohr,et al. Self-organization of Ce adatoms on Ag(111) : A kinetic Monte Carlo study , 2006 .
[52] Banggui Liu,et al. Current controlled spin reversal of nanomagnets with giant uniaxial anisotropy. , 2006, Physical review letters.
[53] Banggui Liu,et al. Long-range ferromagnetism in one-dimensional monatomic spin chains , 2006 .
[54] D. Wales,et al. Graph transformation method for calculating waiting times in Markov chains. , 2006, The Journal of chemical physics.
[55] R. Ferrando,et al. Numerical study of growth and relaxation of small C60 nanoclusters , 2006 .
[56] P. Mulheran,et al. Multiscale modeling of island nucleation and growth during cu(100) homoepitaxy , 2006 .
[57] D. Galvão,et al. Computer simulations of gold nanowire formation: the role of outlayer atoms , 2005 .
[58] T. Rahman,et al. Self-learning kinetic Monte Carlo method: Application to Cu(111) , 2005, cond-mat/0507349.
[59] T. Michely,et al. Island shapes, island densities, and stacking-fault formation on Ir(111) : Kinetic Monte Carlo simulations and experiments , 2005 .
[60] Andrej S. Mishenko. Diagrammatic Monte Carlo method as applied to the polaron problems , 2005 .
[61] W. Hergert,et al. Magnetism and structure on the atomic scale: Small cobalt clusters in Cu(001) , 2004 .
[62] D. R. Mason,et al. Stochastic kinetic Monte Carlo algorithms for long-range Hamiltonians , 2004, Comput. Phys. Commun..
[63] W. Hergert,et al. Ab Initio approach for atomic relaxation in supported magnetic clusters , 2004, cond-mat/0405674.
[64] T. Ala‐Nissila,et al. Searching for transition paths in multidimensional space with a fixed repulsive bias potential , 2004 .
[65] D. Wales,et al. A doubly nudged elastic band method for finding transition states. , 2004, The Journal of chemical physics.
[66] Graeme Henkelman,et al. Multiple time scale simulations of metal crystal growth reveal the importance of multiatom surface processes. , 2003, Physical review letters.
[67] M. Scheffler,et al. Non-arrhenius behavior of the island density in metal heteroepitaxy: Co on Cu(001). , 2003, Physical review letters.
[68] James P. Sethna,et al. Kinetic Monte Carlo-molecular dynamics investigations of hyperthermal copper deposition on Cu(111) , 2002 .
[69] U. Kürpick. Effect of adsorbate interactions on adatom self-diffusion on Cu(111) and Ni(111) surfaces , 2002 .
[70] D. Srolovitz,et al. First passage time Markov chain analysis of rare events for kinetic Monte Carlo: double kink nucleation during dislocation glide , 2002 .
[71] G. Henkelman,et al. Long time scale kinetic Monte Carlo simulations without lattice approximation and predefined event table , 2001 .
[72] U. Kürpick. Self-diffusion on (100), (110), and (111) surfaces of Ni and Cu: A detailed study of prefactors and activation energies , 2001 .
[73] R. Needs,et al. Quantum Monte Carlo simulations of solids , 2001 .
[74] G. Henkelman,et al. Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points , 2000 .
[75] G. Henkelman,et al. A climbing image nudged elastic band method for finding saddle points and minimum energy paths , 2000 .
[76] D. Ugarte,et al. Signature of atomic structure in the quantum conductance of gold nanowires. , 2000, Physical review letters.
[77] Brune,et al. Nature, strength, and consequences of indirect adsorbate interactions on metals , 2000, Physical review letters.
[78] T. Einstein,et al. Electromigration of single-layer clusters , 2000, cond-mat/0007108.
[79] A. Voter,et al. Temperature-accelerated dynamics for simulation of infrequent events , 2000 .
[80] P. Hyldgaard,et al. Long-ranged adsorbate-adsorbate interactions mediated by a surface-state band , 2000 .
[81] O. Biham,et al. Electromigration-induced flow of islands and voids on the Cu(001) surface , 1999, cond-mat/9905432.
[82] A. La Magna,et al. Accelerated Monte Carlo algorithms for defect diffusion and clustering , 2000 .
[83] G. Henkelman,et al. A dimer method for finding saddle points on high dimensional potential surfaces using only first derivatives , 1999 .
[84] Walter Kohn,et al. Nobel Lecture: Electronic structure of matter-wave functions and density functionals , 1999 .
[85] Alexander Bogicevic,et al. Origin of Compact Triangular Islands in Metal-on-Metal Growth , 1999 .
[86] A. Murtazaev,et al. Monte Carlo studies of phase transitions and critical phenomena , 1999 .
[87] O. Biham,et al. Models for adatom diffusion on fcc (001) metal surfaces , 1999, cond-mat/9905358.
[88] T. Rahman,et al. MONOVACANCY DIFFUSION ON AG(100), CU(100), AND NI(100) : PREFACTORS AND ACTIVATION BARRIERS , 1999 .
[89] D. Belashchenko. Diffusion mechanisms in disordered systems: computer simulation , 1999 .
[90] T. Ala‐Nissila,et al. Island diffusion on metal fcc(100) surfaces , 1999, cond-mat/9903186.
[91] David K Belashchenko. Diffusion mechanisms in disordered systems: computer simulation , 1999 .
[92] B. Lundqvist,et al. LOW-SYMMETRY DIFFUSION BARRIERS IN HOMOEPITAXIAL GROWTH OF AL(111) , 1998 .
[93] A. Voter. Parallel replica method for dynamics of infrequent events , 1998 .
[94] T. Rahman,et al. Diffusion processes relevant to homoepitaxial growth on Ag(100) , 1998 .
[95] R. Sorbello,et al. Theory of Electromigration , 1998 .
[96] A. Voter. Hyperdynamics: Accelerated Molecular Dynamics of Infrequent Events , 1997 .
[97] L. J. Lewis,et al. Self-diffusion of adatoms, dimers, and vacancies on Cu(100) , 1997, cond-mat/9704009.
[98] A. Voter. A method for accelerating the molecular dynamics simulation of infrequent events , 1997 .
[99] V. Kandidov. Monte Carlo method in nonlinear statistical optics , 1996 .
[100] O. Biham,et al. Models for diffusion and island growth in metal monolayers , 1996, cond-mat/9611095.
[101] Barkema,et al. Event-Based Relaxation of Continuous Disordered Systems. , 1996, Physical review letters.
[102] Maier,et al. Growth of Co on a stepped and on a flat Cu(001) surface. , 1996, Physical review. B, Condensed matter.
[103] Lewis,et al. Many-body nature of the Meyer-Neldel compensation law for diffusion. , 1995, Physical review letters.
[104] Jacobsen,et al. Island shape-induced transition from 2D to 3D growth for Pt/Pt(111). , 1995, Physical review letters.
[105] Nóvotný,et al. Monte Carlo algorithms with absorbing Markov chains: Fast local algorithms for slow dynamics. , 1994, Physical review letters.
[106] Wolfgang von der Linden,et al. A quantum Monte Carlo approach to many-body physics , 1992 .
[107] D. E. Sanders,et al. Predicted diffusion rates on fcc (001) metal surfaces for adsorbate/substrate combinations of Ni, Cu, Rh, Pd, Ag, Pt, Au , 1992 .
[108] W. H. Weinberg,et al. Theoretical foundations of dynamical Monte Carlo simulations , 1991 .
[109] R. Watts,et al. Quantum Monte Carlo studies of vibrational states in molecules and clusters , 1991 .
[110] D. Stauffer. Monte Carlo simulations in statistical physics , 1988 .
[111] A. Voter,et al. Classically exact overlayer dynamics: Diffusion of rhodium clusters on Rh(100). , 1986, Physical review. B, Condensed matter.
[112] Car,et al. Unified approach for molecular dynamics and density-functional theory. , 1985, Physical review letters.
[113] A. Lagendijk,et al. Monte Carlo simulation of quantum statistical lattice models , 1985 .
[114] K. Binder. Applications of the Monte Carlo Method in Statistical Physics , 2012 .
[115] Y. Makeenko. The Monte Carlo method in lattice gauge theories , 1984 .
[116] C. Jacoboni,et al. The Monte Carlo method for the solution of charge transport in semiconductors with applications to covalent materials , 1983 .
[117] Claudio Rebbi,et al. Monte Carlo computations in lattice gauge theories , 1983 .
[118] G. Vineyard. Frequency factors and isotope effects in solid state rate processes , 1957 .
[119] N. Metropolis,et al. Equation of State Calculations by Fast Computing Machines , 1953, Resonance.