Selected Publications

2015

Catechol and HCl Adsorption on TiO2 (110) in Vacuum and at the Water\textendashTiO2 Interface
Kristoffersen, H. H., Shea, J. -E., & Metiu, H. (2015). Catechol and HCl Adsorption on TiO2 (110) in Vacuum and at the Water\textendashTiO2 Interface. The Journal Of Physical Chemistry Letters, 6, 2277\textendash2281.
Computational Studies of Protein Aggregation: Methods and Applications
Morriss-Andrews, A., & Shea, J. -E. (2015). Computational Studies of Protein Aggregation: Methods and Applications. Annual Review Of Physical Chemistry, 66, 643\textendash666.
Continuous Mott Transition between a Metal and a Quantum Spin Liquid
Mishmash, R., Gonzalez, I., Melko, R. G., Motrunich, O. I., & Fisher, M. (2015). Continuous Mott Transition between a Metal and a Quantum Spin Liquid. Physical Review B, 91, 16. https://doi.org/10.1103/PhysRevB.91.235140 (Original work published 06/2015 C.E.)
Creating extremely asymmetric lamellar structures via fluctuation-assisted unbinding of miktoarm star block copolymer alloys
Shi, W., Hamilton, A. L., Delaney, K., Fredrickson, G. H., Kramer, E. J., Ntaras, C., et al. (2015). Creating extremely asymmetric lamellar structures via fluctuation-assisted unbinding of miktoarm star block copolymer alloys. Journal Of The American Chemical Society.
Crystal and Electronic Structures of Complex Bismuth Iodides A 3Bi2I9 (A= K, Rb, Cs) Related to Perovskite: Aiding the Rational Design of Photovoltaics
Lehner, A. J., Fabini, D. H., Evans, H. A., Hébert, C. -A., Smock, S. R., Hu, J., et al. (2015). Crystal and Electronic Structures of Complex Bismuth Iodides A 3Bi2I9 (A= K, Rb, Cs) Related to Perovskite: Aiding the Rational Design of Photovoltaics. Chemistry Of Materials, 27, 7137\textendash7148.
Defects as qubits in 3 C- and 4 H- SiC
Gordon, L., Janotti, A., & Van de Walle, C. G. (2015). Defects as qubits in 3 C- and 4 H- SiC. Physical Review B, 92, 045208.
Departures from neutrality induced by niche and relative fitness differences
Carroll, I. T., & Nisbet, R. M. (2015). Departures from neutrality induced by niche and relative fitness differences. Theoretical Ecology, 1\textendash17.
A Desulfonylative Approach in Oxidative Gold Catalysis: Regiospecific Access to Donor-Substituted Acyl Gold Carbenes
Chen, H., & Zhang, L. (2015). A Desulfonylative Approach in Oxidative Gold Catalysis: Regiospecific Access to Donor-Substituted Acyl Gold Carbenes. Angewandte Chemie, 127, 11941\textendash11945.
Determination of the Mott-Hubbard gap in GdTiO 3
Bjaalie, L., Verma, A., Himmetoglu, B., Janotti, A., Raghavan, S., Protasenko, V., et al. (2015). Determination of the Mott-Hubbard gap in GdTiO 3. Physical Review B, 92, 085111.
Directed self-assembly of diblock copolymers in cylindrical confinement: effect of underfilling and air-polymer interactions on configurations
Carpenter, C. L., Delaney, K. T., Laachi, N., & Fredrickson, G. H. (2015). Directed self-assembly of diblock copolymers in cylindrical confinement: effect of underfilling and air-polymer interactions on configurations. Presented at the. International Society for Optics and Photonics.
Directed self-assembly of linear arrays of block copolymer cylinders
Laachi, N., Iwama, T., Delaney, K. T., Shykind, D., Weinheimer, C. J., & Fredrickson, G. H. (2015). Directed self-assembly of linear arrays of block copolymer cylinders. Journal Of Polymer Science Part B: Polymer Physics, 53, 317\textendash326. https://doi.org/10.1002/polb.23630 (Original work published 03/2015 C.E.)
Directed self-assembly of linear arrays of block copolymer cylinders
Laachi, N., Iwama, T., Delaney, K. T., Shykind, D., Weinheimer, C. J., & Fredrickson, G. H. (2015). Directed self-assembly of linear arrays of block copolymer cylinders. Journal Of Polymer Science Part B: Polymer Physics, 53, 317\textendash326. https://doi.org/10.1002/polb.23630 (Original work published 03/2016 C.E.)
Easy Transition Path Sampling Methods: Flexible Length Aimless Shooting and Permutation Shooting
Mullen, R. G., Shea, J. -E., & Peters, B. (2015). Easy Transition Path Sampling Methods: Flexible Length Aimless Shooting and Permutation Shooting. Journal Of Chemical Theory And Computation.
Effect of Design on the Performance of Steel-Alumina Bilayers and Trilayers Subject to Ballistic Impact
Holland, C. C., Gamble, E. A., Zok, F. W., Deshpande, V. S., & McMeeking, R. M. (2015). Effect of Design on the Performance of Steel-Alumina Bilayers and Trilayers Subject to Ballistic Impact. Mechanics Of Materials.
The effect of fibre dispersion on initial failure strain and cluster development in unidirectional carbon/glass hybrid composites
Swolfs, Y., McMeeking, R. M., Verpoest, I., & Gorbatikh, L. (2015). The effect of fibre dispersion on initial failure strain and cluster development in unidirectional carbon/glass hybrid composites. Composites Part A: Applied Science And Manufacturing, 69, 279-287. https://doi.org/http://dx.doi.org/10.1016/j.compositesa.2014.12.001
Effects of thermal fluctuations on directed self-assembly in cylindrical confinement
Laachi, N., Iwama, T., Delaney, K. T., Kim, B. J., Bristol, R., Shykind, D., et al. (2015). Effects of thermal fluctuations on directed self-assembly in cylindrical confinement. Journal Of Micro/Nanolithography, Mems, And Moems, 14, 013505. https://doi.org/10.1117/1.JMM.14.1.013505 (Original work published 02/2015 C.E.)
Effects of weave architecture on mechanical response of 2D ceramic composites
Rossol, M. N., Rajan, V. P., & Zok, F. W. (2015). Effects of weave architecture on mechanical response of 2D ceramic composites. Composites Part A: Applied Science And Manufacturing, 74, 141\textendash152.
Eigenstate thermalization in systems with spontaneously broken symmetry
Fratus, K. R., & Srednicki, M. (2015). Eigenstate thermalization in systems with spontaneously broken symmetry. Physical Review E, 92, 040103.
Electronic structure and photovoltaic application of BiI3
Lehner, A. J., Wang, H., Fabini, D. H., Liman, C. D., ebert, C. -A. H. \, Perry, E. E., et al. (2015). Electronic structure and photovoltaic application of BiI3. Applied Physics Letters, 107, 131109.
Elucidation of the Aggregation Pathways of Helix\textendashTurn\textendashHelix Peptides: Stabilization at the Turn Region Is Critical for Fibril Formation
Do, T. D., Chamas, A., Zheng, X., Barnes, A., Chang, D., Veldstra, T., et al. (2015). Elucidation of the Aggregation Pathways of Helix\textendashTurn\textendashHelix Peptides: Stabilization at the Turn Region Is Critical for Fibril Formation. Biochemistry, 54, 4050\textendash4062.