Publications

Journal Article
Gonzalez-Juez E.D, Meiburg E., Constantinescu S.G.  2009.  Gravity currents impinging on submerged cylinders: flow fields and associated forces. J. Fluid Mech.. 631:65-102.
Khan SA, Vandervelden CA, Scott SL, Peters B.  2020.  Grafting metal complexes onto amorphous supports: from elementary steps to catalyst site populations via kernel regression. Reaction Chemistry & Engineering. 5:66–76.
J Pro W, Lim RKwei, Petzold LR, Utz M, Begley MR.  2015.  GPU-based simulations of fracture in idealized brick and mortar composites. Journal of the Mechanics and Physics of Solids. 80:68–85.
Wang Y, Yepremyan A, Ghorai S, Todd R, Aue DH, Zhang L.  2013.  Gold-Catalyzed Cyclizations of cis-Enediynes: Insights into the Nature of Gold–Aryne Interactions. Angewandte Chemie. 125:7949–7953.
Suen JY, Fang MT, Lubin PM.  2014.  Global Distribution of Water Vapor and Cloud Cover—Sites for High-Performance THz Applications. Terahertz Science and Technology, IEEE Transactions on. 4:86–100.
Adamski NL, Dreyer CE, Van de Walle CG.  2019.  Giant polarization charge density at lattice-matched GaN/ScN interfaces. Applied Physics Letters. 115:232103.
Shelton E, Serwane F, CampÀs O.  2017.  Geometrical characterization of fluorescently labelled surfaces from noisy 3D microscopy data. Journal of microscopy. 269:259–268.
Alexandrou MA, Swartz BA, Matzke NJ, Oakley TH.  2013.  Genome duplication and multiple evolutionary origins of complex migratory behavior in Salmonidae. Molecular phylogenetics and evolution. 69:514–523.
Tsai CL, Delaney KT, Fredrickson GH.  2016.  Genetic Algorithm for Discovery of Globally Stable Phases in Block Copolymers. Macromolecules. 49(17):6558–6567.
Barkeshli M, Jiang H-C, Thomale R, Qi X-L.  2014.  Generalized Kitaev Models and Slave Genons. arXiv preprint arXiv:1405.1780.
Barkeshli M, Jiang H-C, Thomale R, Qi X-L.  2015.  Generalized Kitaev Models and Extrinsic Non-Abelian Twist Defects. Physical Review Letters. 114:026401.
Kang Y, Krishnaswamy K, Peelaers H, Van de Walle CG.  2017.  Fundamental limits on the electron mobility of $\beta$-Ga2O3. Journal of Physics: Condensed Matter. 29:234001.
Peelaers H., Kioupakis E., Van de Walle C.G.  2012.  Fundamental limits on optical transparency of transparent conducting oxides: Free-carrier absorption in SnO2. Applied Physics Letters. 100:011914-011914-3.
Delgadillo R, Yang X, Zhang J.  2017.  Frozen Gaussian Approximation-Based Artificial Boundary Conditions for One-Dimensional Nonlinear Schrödinger Equation in the Semiclassical Regime. Journal of Scientific Computing. :1–20.
Chai L, Tong P, Yang X.  2018.  Frozen Gaussian approximation for 3D seismic tomography. Inverse Problems. 34:055004.
Hateley JC, Chai L, Tong P, Yang X.  2018.  Frozen Gaussian approximation for 3-D elastic wave equation and seismic tomography. Geophysical Journal International. 216:1394–1412.
Peelaers H, Kioupakis E, Van de Walle CG.  2015.  Free-carrier absorption in transparent conducting oxides: Phonon and impurity scattering in SnO 2. Physical Review B. 92:235201.
Kioupakis E, Rinke P, Schleife A, Bechstedt F, Van de Walle CG.  2010.  Free-carrier absorption in nitrides from first principles. Phys. Rev. B. 81:241201.
Baumketner A., Shea J.-E..  2005.  Free Energy Landscapes for Amyloidogenic Tetrapeptides Dimerization. Biophysical Journal. 89:1493-1503.
Xu S, Su Y, Smith LTW, Beyerlein IJ.  2020.  Frank-Read source operation in six body-centered cubic refractory metals. Journal of the Mechanics and Physics of Solids. :104017.
Ratcliff EL, II RCBakus, Welch GC, van der Poll TS, Garcia A, Cowan SR, MacLeod BA, Ginley DS, Bazan GC, Olson DC.  2013.  Formation of interfacial traps upon surface protonation in small molecule solution processed bulk heterojunctions probed by photoelectron spectroscopy. Journal of Materials Chemistry C. 1:6223–6234.
Park MSik, Janotti A, Van de Walle CG.  2009.  Formation and migration of charged point defects in MgH2: First-principles calculations. Phys. Rev. B. 80:64102.
Baumketner A., Shea J.-E..  2006.  Folding landscapes of the Alzheimer A\beta12-28 peptide from all-atom replica exchange molecular dynamics simulations in explicit solvent. J. Mol. Biol.. 362:567-579.
Brandt EG.  2013.  Fluctuating hydrodynamics simulations of coarse-grained lipid membranes under steady-state conditions and in shear flow. Physical Review E. 88:012714.
Camley BA, Brown FLH.  2014.  Fluctuating hydrodynamics of multicomponent membranes with embedded proteins. The Journal of chemical physics. 141:075103.

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