Publications

2019
Xu S, Mianroodi JR, Hunter A, Beyerlein IJ, Svendsen B.  2019.  Phase-field-based calculations of the disregistry fields of static extended dislocations in FCC metals. Philosophical Magazine. 99:1400–1428.
Agarwal V, Metiu H.  2019.  Rates of adsorption and desorption: Entropic contributions and errors due to mean-field approximations. The Journal of chemical physics. 150:184702.
Patterson AL, Danielsen SPO, Yu B, Davidson EC, Fredrickson GH, Segalman RA.  2019.  Sequence Effects on Block Copolymer Self-Assembly through Tuning Chain Conformation and Segregation Strength Utilizing Sequence-Defined Polypeptoids. Macromolecules.
Rooijers K, Markodimitraki CM, Rang FJ, de Vries SS, Chialastri A, de Luca KL, Mooijman D, Dey SS, Kind J.  2019.  Simultaneous quantification of protein–DNA contacts and transcriptomes in single cells. Nature biotechnology. :1.
Bates MW, Lequieu J, Barbon SM, Lewis RM, Delaney KT, Anastasaki A, Hawker CJ, Fredrickson GH, Bates CM.  2019.  Stability of the A15 phase in diblock copolymer melts. Proceedings of the National Academy of Sciences. :201900121.
Adamski NL, Zhu Z, Wickramaratne D, Van de Walle CG.  2019.  Strategies for p-type doping of ZnGeN2. Applied Physics Letters. 114
Phan H, Kelly TJ, Zhugayevych A, Bazan GC, Nguyen T-Q, Jarvis EA, Tretiak S.  2019.  Tuning Optical Properties of Conjugated Molecules by Lewis Acids: Insights from Electronic Structure Modeling. The journal of physical chemistry letters.
Emery B, Washburn L.  2019.  Uncertainty Estimates for SeaSonde HF Radar Ocean Current Observations. Journal of Atmospheric and Oceanic Technology. 36:231–247.
Kaufman JL, Vinckeviči\=ut\.e J, Kolli SKrishna, Goiri JGabriel, Van der Ven A.  2019.  Understanding intercalation compounds for sodium-ion batteries and beyond. Philosophical Transactions of the Royal Society A. 377:20190020.
2018
Kim SJoo, Chang D, Zhang K, Graham G, Van der Ven A, Pan X.  2018.  Accordion Strain Accommodation Mechanism within the Epitaxially Constrained Electrode. ACS Energy Letters. 3:1848-1853.
Weston L, Tailor H, Krishnaswamy K, Bjaalie L, Van de Walle CG.  2018.  Accurate and efficient band-offset calculations from density functional theory. Computational Materials Science. 151:174–180.
Blanco C, Bayas M, Yan F, Chen IA.  2018.  Analysis of Evolutionarily Independent Protein-RNA Complexes Yields a Criterion to Evaluate the Relevance of Prebiotic Scenarios. Current Biology. 28:526–537.
Alexander GCB, Fabini DH, Seshadri R, Kanatzidis MG.  2018.  AuPb2I7: A Narrow Bandgap Au3+ Iodide Semiconductor. Inorganic chemistry.
Bales B, Petzold L, Goodlet BR, Lenthe WC, Pollock TM.  2018.  Bayesian inference of elastic properties with resonant ultrasound spectroscopy. The Journal of the Acoustical Society of America. 143:71–83.
Wang W, Peelaers H, Shen J-X, Van de Walle C.G.  2018.  Carrier-induced absorption as a mechanism for electrochromism in tungsten trioxide. MRS Communications. :1-6.
Fredrickson GH, Delaney KT.  2018.  Coherent states field theory in supramolecular polymer physics. The Journal of chemical physics. 148:204904.
Xu S, Latypov MI, Su Y.  2018.  Concurrent atomistic-continuum simulations of uniaxial compression of gold nano/submicropillars. Philosophical Magazine Letters. 98:173–182.
Natarajan ARaju, Van der Ven A.  2018.  Connecting the Simpler Structures to Topologically Close-Packed Phases. Physical review letters. 121:255701.
Rhein RK, Callahan PG, Murray SP, Stinville J-C, Titus MS, Van der Ven A, Pollock TM.  2018.   Creep Behavior of Quinary γ′-Strengthened Co-Based Superalloys. Metallurgical and Materials Transactions A. :1-9.
Heinze S.G, Natarajan A.R, Levi C.G, Van der Ven A..  2018.  Crystallography and substitution patterns in the ZrO2−YTaO4 system. Phyiscal Review Materials. 2(7):1-9.
Gripaios B., Sutherland D..  2018.   DEFT: A program for operators in EFT. arXiv. :1-21.
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.

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