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Dallas R. Trinkle, Ph.D. - Publications

Affiliations: 
Materials Science and Engineering University of Illinois, Urbana-Champaign, Urbana-Champaign, IL 
Area:
Condensed Matter, Theory
Website:
http://illinois.edu/lb/article/4547/58088
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65 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Gao R, Jain ACP, Pandya S, Dong Y, Yuan Y, Zhou H, Dedon LR, Thoréton V, Saremi S, Xu R, Luo A, Chen T, Gopalan V, Ertekin E, Kilner J, ... ... Trinkle DR, et al. Designing Optimal Perovskite Structure for High Ionic Conduction. Advanced Materials (Deerfield Beach, Fla.). e1905178. PMID 31680355 DOI: 10.1002/Adma.201905178  0.301
2019 Schuler T, Bellon P, Trinkle DR, Averback RS. Erratum: Modeling the long-term evolution of dilute solid solutions in the presence of vacancy fluxes [Phys. Rev. Materials 2 , 073605 (2018)] Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.109901  0.303
2019 Tan AMZ, Woodward C, Trinkle DR. Dislocation core structures in Ni-based superalloys computed using a density functional theory based flexible boundary condition approach Physical Review Materials. 3. DOI: 10.1103/Physrevmaterials.3.033609  0.325
2019 Fellinger MR, Hector Jr LG, Trinkle DR. Impact of solutes on the lattice parameters and elastic stiffness coefficients of hcp Fe from first-principles calculations Computational Materials Science. 164: 116-126. DOI: 10.1016/J.Commatsci.2019.03.056  0.8
2018 Fellinger MR, Tan AMZ, Hector LG, Trinkle DR. Geometries of edge and mixed dislocations in bcc Fe from first-principles calculations Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.113605  0.77
2018 Schuler T, Bellon P, Trinkle DR, Averback RS. Modeling the long-term evolution of dilute solid solutions in the presence of vacancy fluxes Physical Review Materials. 2. DOI: 10.1103/Physrevmaterials.2.073605  0.303
2018 Fellinger MR, Hector LG, Trinkle DR. Effect of solutes on the lattice parameters and elastic stiffness coefficients of body-centered tetragonal Fe Computational Materials Science. 152: 308-323. DOI: 10.1016/J.Commatsci.2018.05.021  0.79
2018 Hooshmand M, Niu C, Trinkle D, Ghazisaeidi M. First-principles prediction of oxygen diffusivity near the (101¯2) twin boundary in titanium Acta Materialia. 156: 11-19. DOI: 10.1016/J.Actamat.2018.05.076  0.32
2018 Agarwal R, Trinkle DR. Ab initio magnesium-solute transport database using exact diffusion theory Acta Materialia. 150: 339-350. DOI: 10.1016/J.Actamat.2018.03.025  0.387
2017 Agarwal R, Trinkle DR. Exact Model of Vacancy-Mediated Solute Transport in Magnesium. Physical Review Letters. 118: 105901. PMID 28339274 DOI: 10.1103/Physrevlett.118.105901  0.383
2017 Fellinger MR, Hector LG, Trinkle DR. Data files for ab initio calculations of the lattice parameter and elastic stiffness coefficients of bcc Fe with solutes. Data in Brief. 10: 147-150. PMID 27981205 DOI: 10.1016/J.Dib.2016.11.092  0.785
2017 Kim H, Trinkle DR. Mechanical properties and phase stability of monoborides using density functional theory calculations Physical Review Materials. 1. DOI: 10.1103/Physrevmaterials.1.013601  0.321
2017 Li Z, Trinkle DR. Mesoscale modeling of vacancy-mediated Si segregation near an edge dislocation in Ni under irradiation Physical Review B. 95. DOI: 10.1103/Physrevb.95.144107  0.314
2017 Trinkle DR. Automatic numerical evaluation of vacancy-mediated transport for arbitrary crystals: Onsager coefficients in the dilute limit using a Green function approach Philosophical Magazine. 97: 2514-2563. DOI: 10.1080/14786435.2017.1340685  0.343
2017 Fellinger MR, Hector LG, Trinkle DR. Ab initio calculations of the lattice parameter and elastic stiffness coefficients of bcc Fe with solutes Computational Materials Science. 126: 503-513. DOI: 10.1016/J.Commatsci.2016.09.040  0.794
2017 Hu Y, Fellinger MR, Butler BG, Wang Y, Darling KA, Kecskes LJ, Trinkle DR, Liu Z. Solute-induced solid-solution softening and hardening in bcc tungsten Acta Materialia. 141: 304-316. DOI: 10.1016/J.Actamat.2017.09.019  0.799
2017 Jain ACP, Trinkle DR. First principles calculations of beryllium stability in zirconium surfaces Acta Materialia. 122: 359-368. DOI: 10.1016/J.Actamat.2016.10.003  0.321
2016 Tan AM, Trinkle DR. Computation of the lattice Green function for a dislocation. Physical Review. E. 94: 023308. PMID 27627413 DOI: 10.1103/Physreve.94.023308  0.36
2016 Li Z, Trinkle DR. Kinetic Monte Carlo investigation of tetragonal strain on Onsager matrices. Physical Review. E. 93: 053305. PMID 27301003 DOI: 10.1103/Physreve.93.053305  0.308
2016 Schiavone EJ, Trinkle DR. Ab initiomodeling of quasielastic neutron scattering of hydrogen pipe diffusion in palladium Physical Review B. 94. DOI: 10.1103/Physrevb.94.054114  0.319
2016 Agarwal R, Trinkle DR. Light-element diffusion in Mg using first-principles calculations: Anisotropy and elastodiffusion Physical Review B - Condensed Matter and Materials Physics. 94. DOI: 10.1103/Physrevb.94.054106  0.313
2016 Trinkle DR. Diffusivity and derivatives for interstitial solutes: activation energy, volume, and elastodiffusion tensors Philosophical Magazine. 96: 2714-2735. DOI: 10.1080/14786435.2016.1212175  0.342
2016 Zhang P, Trinkle DR. A modified embedded atom method potential for interstitial oxygen in titanium Computational Materials Science. 124: 204-210. DOI: 10.1016/J.Commatsci.2016.07.039  0.322
2015 Hohensee GT, Fellinger MR, Trinkle DR, Cahill DG. Thermal transport across high-pressure semiconductor-metal transition in Si and Si0.991 Ge0.009 Physical Review B - Condensed Matter and Materials Physics. 91. DOI: 10.1103/Physrevb.91.205104  0.746
2015 Zhang P, Trinkle DR. Database optimization for empirical interatomic potential models Modelling and Simulation in Materials Science and Engineering. 23. DOI: 10.1088/0965-0393/23/6/065011  0.305
2015 Lee B, Trinkle DR. Energetics of Rutile TiO2 Vicinal Surfaces with <001> Steps from the Energy Density Method Journal of Physical Chemistry C. 119: 18203-18209. DOI: 10.1021/Acs.Jpcc.5B03623  0.354
2015 Tang W, Halm KL, Trinkle DR, Koker MKA, Lienert U, Kenesei P, Beaudoin AJ. A study of stress relaxation in AZ31 using high-energy X-ray diffraction Acta Materialia. 101: 71-79. DOI: 10.1016/J.Actamat.2015.08.072  0.326
2015 Huang LF, Grabowski B, Mceniry E, Trinkle DR, Neugebauer J. Importance of coordination number and bond length in titanium revealed by electronic structure investigations Physica Status Solidi (B) Basic Research. 252: 1907-1924. DOI: 10.1002/Pssb.201552280  0.349
2014 Garnier T, Li Z, Nastar M, Bellon P, Trinkle DR. Calculation of strain effects on vacancy-mediated diffusion of impurities in fcc structures: General approach and application to Ni1-x Six Physical Review B - Condensed Matter and Materials Physics. 90. DOI: 10.1103/Physrevb.90.184301  0.333
2014 Garnier T, Trinkle DR, Nastar M, Bellon P. Quantitative modeling of solute drag by vacancies in face-centered-cubic alloys Physical Review B - Condensed Matter and Materials Physics. 89. DOI: 10.1103/Physrevb.89.144202  0.365
2014 Ghazisaeidi M, Trinkle DR. Interaction of oxygen interstitials with lattice faults in Ti Acta Materialia. 76: 82-86. DOI: 10.1016/J.Actamat.2014.05.025  0.692
2014 Woodward C, Van De Walle A, Asta M, Trinkle DR. First-principles study of interfacial boundaries in Ni-Ni3Al Acta Materialia. 75: 60-70. DOI: 10.1016/J.Actamat.2014.04.056  0.335
2013 Garnier T, Nastar M, Bellon P, Trinkle DR. Solute drag by vacancies in body-centered cubic alloys Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.134201  0.358
2013 Garnier T, Manga VR, Trinkle DR, Nastar M, Bellon P. Stress-induced anisotropic diffusion in alloys: Complex Si solute flow near a dislocation core in Ni Physical Review B - Condensed Matter and Materials Physics. 88. DOI: 10.1103/Physrevb.88.134108  0.36
2013 Wu HH, Trinkle DR. Solute effect on oxygen diffusion in α-titanium Journal of Applied Physics. 113. DOI: 10.1063/1.4808283  0.382
2013 Heuser BJ, Trinkle DR, Yang DR, He L. Hydrogen trapping at dislocation cores at room temperature in deformed Pd Journal of Alloys and Compounds. 577: 189-191. DOI: 10.1016/J.Jallcom.2013.04.082  0.303
2012 Yasi JA, Trinkle DR. Direct calculation of the lattice Green function with arbitrary interactions for general crystals. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 85: 066706. PMID 23005242 DOI: 10.1103/Physreve.85.066706  0.767
2012 Park H, Fellinger MR, Lenosky TJ, Tipton WW, Trinkle DR, Rudin SP, Woodward C, Wilkins JW, Hennig RG. Ab initio based empirical potential used to study the mechanical properties of molybdenum Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.214121  0.78
2012 Yasi JA, Hector LG, Trinkle DR. Prediction of thermal cross-slip stress in magnesium alloys from a geometric interaction model Acta Materialia. 60: 2350-2358. DOI: 10.1016/J.Actamat.2012.01.004  0.784
2012 Ghazisaeidi M, Trinkle DR. Core structure of a screw dislocation in Ti from density functional theory and classical potentials Acta Materialia. 60: 1287-1292. DOI: 10.1016/J.Actamat.2011.11.024  0.734
2012 Woodward C, Lill J, Asta M, Trinkle DR. Molecular-dynamics simulations of molten Ni-based superalloys Proceedings of the International Symposium On Superalloys. 537-545. DOI: 10.1002/9781118516430.Ch59  0.375
2011 Trinkle DR, Ju H, Heuser BJ, Udovic TJ. Nanoscale hydride formation at dislocations in palladium: Ab initio theory and inelastic neutron scattering measurements Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.174116  0.301
2011 Yu M, Trinkle DR, Martin RM. Energy density in density functional theory: Application to crystalline defects and surfaces Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.115113  0.381
2011 Yu M, Trinkle DR. Au/TiO2(110) interfacial reconstruction stability from ab initio Journal of Physical Chemistry C. 115: 17799-17805. DOI: 10.1021/Jp2017133  0.32
2011 Yasi JA, Hector LG, Trinkle DR. Prediction of thermal cross-slip stress in magnesium alloys from direct first-principles data Acta Materialia. 59: 5652-5660. DOI: 10.1016/J.Actamat.2011.05.040  0.791
2011 Trinkle DR, Yasi JA, Hector LG. Predicting Mg strength from first-principles: Solid-solution strengthening, softening, and cross-slip Magnesium Technology. 13-15.  0.745
2010 Ghazisaeidi M, Trinkle DR. Lattice Green's function for crystals containing a planar interface Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.064115  0.713
2010 Woodward C, Asta M, Trinkle DR, Lill J, Angioletti-Uberti S. Ab initio simulations of molten Ni alloys Journal of Applied Physics. 107. DOI: 10.1063/1.3437644  0.364
2010 Yasi JA, Hector LG, Trinkle DR. First-principles data for solid-solution strengthening of magnesium: From geometry and chemistry to properties Acta Materialia. 58: 5704-5713. DOI: 10.1016/J.Actamat.2010.06.045  0.784
2010 Nogaret T, Curtin WA, Yasi JA, Hector LG, Trinkle DR. Atomistic study of edge and screw (c + a) dislocations in magnesium Acta Materialia. 58: 4332-4333. DOI: 10.1016/J.Actamat.2010.04.022  0.771
2010 Thornton K, Trinkle DR, Hennig RG. Applying for computational time on NSF's TeraGrid-the world's largest cyberinfrastructure supporting open research Jom. 62: 17-18. DOI: 10.1007/S11837-010-0042-6  0.521
2009 Ghazisaeidi M, Trinkle DR. Convergence rate for numerical computation of the lattice Green's function. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 79: 037701. PMID 19392089 DOI: 10.1103/Physreve.79.037701  0.699
2009 Yasi JA, Nogaret T, Trinkle DR, Qi Y, Hector LG, Curtin WA. Basal and prism dislocation cores in magnesium: Comparison of first-principles and embedded-atom-potential methods predictions Modelling and Simulation in Materials Science and Engineering. 17. DOI: 10.1088/0965-0393/17/5/055012  0.772
2009 Wu HH, Trinkle DR. Cu/Ag EAM potential optimized for heteroepitaxial diffusion from ab initio data Computational Materials Science. 47: 577-583. DOI: 10.1016/J.Commatsci.2009.09.026  0.313
2008 Woodward C, Trinkle DR, Hector LG, Olmsted DL. Prediction of dislocation cores in aluminum from density functional theory. Physical Review Letters. 100: 045507. PMID 18352300 DOI: 10.1103/Physrevlett.100.045507  0.353
2008 Hennig RG, Lenosky TJ, Trinkle DR, Rudin SP, Wilkins JW. Classical potential describes martensitic phase transformations between the α, β, and ω titanium phases Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.054121  0.752
2008 Trinkle DR. Lattice Green function for extended defect calculations: Computation and error estimation with long-range forces Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.014110  0.352
2007 Trinkle DR. Lattice and elastic constants of titanium-niobium monoborides containing aluminum and vanadium Scripta Materialia. 56: 273-276. DOI: 10.1016/J.Scriptamat.2006.10.030  0.369
2006 Trinkle DR, Jones MD, Hennig RG, Rudin SP, Albers RC, Wilkins JW. Empirical tight-binding model for titanium phase transformations Physical Review B - Condensed Matter and Materials Physics. 73. DOI: 10.1103/Physrevb.73.094123  0.779
2005 Trinkle DR, Woodward C. The chemistry of deformation: how solutes soften pure metals. Science (New York, N.Y.). 310: 1665-7. PMID 16339441 DOI: 10.1126/Science.1118616  0.358
2005 Hennig RG, Trinkle DR, Bouchet J, Srinivasan SG, Albers RC, Wilkins JW. Impurities block the alpha to omega martensitic transformation in titanium. Nature Materials. 4: 129-33. PMID 15665839 DOI: 10.1038/Nmat1292  0.775
2005 Trinkle DR, Hatch DM, Stokes HT, Hennig RG, Albers RC. Systematic pathway generation and sorting in martensitic transformations: Titanium α to ω Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.014105  0.758
2003 Trinkle DR, Hennig RG, Srinivasan SG, Hatch DM, Jones MD, Stokes HT, Albers RC, Wilkins JW. New mechanism for the alpha to omega martensitic transformation in pure titanium. Physical Review Letters. 91: 025701. PMID 12906490 DOI: 10.1103/Physrevlett.91.025701  0.755
2003 Trinkle DR, Hennig RG, Srinivasan SG, Hatch DM, Jones MD, Stokes HT, Albers RC, Wilkins JW. New mechanism for the α to ω martensitic transformation in pure titanium Physical Review Letters. 91: 025701/1-025701/4.  0.64
2001 Greeff CW, Trinkle DR, Albers RC. Shock-induced α-ω transition in titanium Journal of Applied Physics. 90: 2221-2226. DOI: 10.1063/1.1389334  0.679
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