Publications

2018
Garrison JR, Grover T.  2018.  Does a single eigenstate encode the full Hamiltonian? Physical Review X. 8:021026.
Arsiccio A, McCarty J, Pisano R, Shea J-E.  2018.  Effect of Surfactants on Surface-Induced Denaturation of Proteins: Evidence of an Orientation-Dependent Mechanism. The Journal of Physical Chemistry B. 122:11390–11399.
Grzetic DJ, Delaney KT, Fredrickson GH.  2018.  The effective χ parameter in polarizable polymeric systems: One-loop perturbation theory and field-theoretic simulations. The Journal of chemical physics. 148:204903.
Sidhu IS, Frischknecht AL, Atzberger PJ.  2018.  Electrostatics of Particle Confinement within Nanochannels: Role of.
Esponda I, Vespa E.  2018.  Endogenous sample selection: A laboratory study. Quantitative Economics. 9:183–216.
Yan L.  2018.  Entropy favors heterogeneous structures of networks near the rigidity threshold. Nature communications. 9:1359.
Landstrom EB, Handa S, Aue DH, Gallou F, Lipshutz BH.  2018.  EvanPhos: a ligand for ppm level Pd-catalyzed Suzuki–Miyaura couplings in either organic solvent or water. Green Chemistry. (15):3436-3443.
Parker E, Balents L.  2018.  Finite-temperature behavior of a classical spin-orbit-coupled model for ${\mathrm{YbMgGaO}}_{4}$ with and without bond disorder. Phys. Rev. B. 97:184413.
Lyons JL, Varley JB, Janotti A, Van de Walle CG.  2018.  First-principles calculations of optical transitions at native defects and impurities in ZnO. Oxide-based Materials and Devices IX.
Wang W, Peelaers H, Shen J-X, Janotti A, Van de Walle CG.  2018.  First-principles characterization of defects in WO 3. Oxide-based Materials and Devices IX.
Kang Y, Peelaers H, Krishnaswamy K, Van de Walle CG.  2018.  First-principles study of direct and indirect optical absorption in BaSnO3. Applied Physics Letters. 112:062106.
Wang Y, Lei HUAN, Atzberger PJ.  2018.  Fluctuating hydrodynamic methods for fluid-structure interactions in confined channel geometries. Applied Mathematics and Mechanics. 39:125–152.
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.
Chai L, Tong P, Yang X.  2018.  Frozen Gaussian approximation for 3D seismic tomography. Inverse Problems. 34:055004.
Yang P-L, Marek-Sadowska M.  2018.  High-Performance Architecture Using Fast Dynamic Reconfigurable Accelerators. IEEE Transactions on Very Large Scale Integration (VLSI) Systems. 26(7)
Boldissar S, De Vries MS.  2018.  How nature covers its bases. Physical Chemistry Chemical Physics. 20:9701–9716.
Evans HA, Fabini DH, Andrews JL, Koerner M, Preefer MB, Wu G, Wudl F, Cheetham AK, Seshadri R.  2018.  Hydrogen Bonding Controls the Structural Evolution in Perovskite-Related Hybrid Platinum (IV) Iodides. Inorganic chemistry. 57:10375–10382.
Wang W, Peelaers H, Shen J-X, Janotti A, Van de Walle CG.  2018.  Impact of point defects on electrochromism in WO 3. Oxide-based Materials and Devices IX.
Joswiak MN, Peters B, Doherty MF.  2018.  In Silico Crystal Growth Rate Prediction for NaCl from Aqueous Solution. Crystal Growth & Design. 18:6302–6306.
Joswiak MN, Doherty MF, Peters B.  2018.  Ion dissolution mechanism and kinetics at kink sites on NaCl surfaces. Proceedings of the National Academy of Sciences. :201713452.
Natarajan ARaju, Van der Ven A.  2018.  Machine-learning the configurational energy of multicomponent crystalline solids. npj Computational Materials. 4:56.
Tree DR, Iwama T, Delaney KT, Lee J, Fredrickson GH.  2018.  Marangoni Flows during Nonsolvent Induced Phase Separation. ACS Macro Letters. 7:582–586.
Henske JK, Wilken SElmo, Solomon KV, Smallwood CR, Shutthanandan V, Evans JE, Theodorou MK, O'Malley MA.  2018.  Metabolic characterization of anaerobic fungi provides a path forward for bioprocessing of crude lignocellulose. Biotechnology and bioengineering.
Smith D.J, Leal L.G, Mitragotri S., Shell M.S.  2018.  Nanoparticle transport across model cellular membranes: when do solubility-diffusion models break down? Journal of Physics D: Applied Physics. 51(29):1-15.
Weston L., Wikramaratne D., Alkauskas A., Van de Walle C.G.  2018.  Native point defects and impurities in hexagonal boron nitride. Physical Review B. (97):1-13.

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