Reduced yield stress for zirconium exposed to iodine: reactive force field simulation

[1]  C. Taylor,et al.  First-principles insights into the nature of zirconium–iodine interactions and the initiation of iodine-induced stress–corrosion cracking , 2015 .

[2]  Adri C. T. van Duin,et al.  Reduced yield stress for zirconium exposed to iodine: reactive force field simulation , 2014, Advanced Modeling and Simulation in Engineering Sciences.

[3]  C. Taylor,et al.  Equations of state for crystalline zirconium iodide: The role of dispersion , 2013 .

[4]  H. Abe,et al.  Iodine-Induced Stress Corrosion Cracking of Zircaloy-4: Identification of Critical Parameters Involved in Intergranular to Transgranular Crack Propagation , 2011 .

[5]  C. Taylor,et al.  Atomistic Simulations of Formation of Elementary Zr-I Systems , 2011 .

[6]  C. Svaneborg.  Large-scale Atomic/Molecular Massively Parallel Simulator , 2011 .

[7]  William T. Thompson,et al.  Modelling of iodine-induced stress corrosion cracking in CANDU fuel , 2011 .

[8]  J. Vollmer,et al.  Ab initio calculations for industrial materials engineering: successes and challenges , 2010, Journal of physics. Condensed matter : an Institute of Physics journal.

[9]  G. Cailletaud,et al.  Simulation of inter- and transgranular crack propagation in polycrystalline aggregates due to stress corrosion cracking , 2009 .

[10]  A. V. van Duin,et al.  ReaxFF reactive force field for molecular dynamics simulations of hydrocarbon oxidation. , 2008, The journal of physical chemistry. A.

[11]  Sang Yoon Park,et al.  Crack initiation and propagation behavior of zirconium cladding under an environment of iodine-induced stress corrosion , 2007 .

[12]  Y. Jeong,et al.  Effect of Annealing Conditions on the Microstructure and Corrosion Characteristics of Zr-xNb Alloys , 2006 .

[13]  C. Domain,et al.  Ab initio atomic-scale modelling of iodine effects on hcp zirconium , 2005 .

[14]  S. Farina,et al.  Intergranular to transgranular transition in the stress corrosion cracking of Zircaloy-4 , 2004 .

[15]  Gerbrand Ceder,et al.  The thermodynamics of decohesion , 2004 .

[16]  J. Galvele,et al.  LOCALIZED CORROSION OF ZIRCONIUM AND ZIRCALOY-4 IN IODINE ALCOHOLIC SOLUTIONS , 2002 .

[17]  Vladimir V. Likhanskii,et al.  The development of the crack growth model in zirconium claddings in iodine environment , 2002 .

[18]  A. V. Duin,et al.  ReaxFF: A Reactive Force Field for Hydrocarbons , 2001 .

[19]  Steve Plimpton,et al.  Fast parallel algorithms for short-range molecular dynamics , 1993 .

[20]  V. Novikov,et al.  Iodine induced SCC of Zr alloys at constant strain rate , 1992 .

[21]  I. Schuster,et al.  Influence of texture on iodine-induced stress corrosion cracking of Zircaloy-4 cladding tubes , 1992 .

[22]  C. Catlow,et al.  Site preference and binding of iodine and caesium in uranium dioxide , 1992 .

[23]  Brian J. Cox,et al.  Pellet-clad interaction (PCI) failures of zirconium alloy fuel cladding — A review , 1990 .

[24]  A. Atrens,et al.  Stress-corrosion-cracking of Zircaloy-4 cladding tubes: Part 1. Threshold in the presence of iodine , 1984 .

[25]  K. Konashi,et al.  Estimation of irradiation induced iodine pressure in an LWR fuel rod , 1984 .

[26]  O. Götzmann.  Thermochemical evaluation of PCI failures in LWR fuel pins , 1982 .

[27]  K. Lau,et al.  Thermodynamics of Vaporization and High Temperature Enthalpy of Zirconium Tetraiodide , 1978 .

[28]  C. Farr.  Quarterly Progress Reports , 1955 .

[29]  A. E. Arkel,et al.  Darstellung von reinem Titanium‐, Zirkonium‐, Hafnium‐ und Thoriummetall , 1925 .

[30]  S. B. Farinaa,et al.  Stress Corrosion Cracking of Zircaloy-4 in Halide Solutions . Effect of Temperature , 2002 .

[31]  R. Brown.  Effect of temperature , 1996 .

[32]  Mary Eagleson,et al.  Concise encyclopedia chemistry , 1994 .

[33]  M. R. Louthan,et al.  Environmental degradation of engineering materials in aggressive environments : proceedings of Second International Conference on Environmental Degradation of Engineering Materials, September 21-23, 1981, Virginia Polytechnic Institute, Blacksburg, Va. , 1981 .

[34]  Harold B. Fairchild.  The properties of zirconium and its possibilities for thermal reactors , 1949 .