Publications
“Structural Role of Uracil DNA Glycosylase for the Recognition of Uracil in DNA Duplexes. Clues from Atomistic Simulations”, Journal of Chemical Information and Modeling, vol. 53, pp. 1371–1387, 2013.
, “Structure change, layer sliding, and metallization in high-pressure MoS2”, Physical Review B, vol. 87, p. 144105, 2013.
, “Structure of Ultrathin CeO2 Films on Pt(111) by Polarization-Dependent X-ray Absorption Fine Structure”, Journal of Physical Chemistry C, vol. 117, pp. 1030–1036, 2013.
, “Structure-Function Paradigm in Human Myoglobin: How a Single-Residue Substitution Affects NO Reactivity at Low pO(2)”, Journal of the American Chemical Society, vol. 135, pp. 7534–7544, 2013.
, “Studies of the interface of conducting polymers with inorganic surfaces”, Analytical and Bioanalytical Chemistry, vol. 405, pp. 1513–1535, 2013.
, “Study of the Boson Peak and Fragility of Bioprotectant Glass-Forming Mixtures by Neutron Scattering”, Advances In Materials Science and Engineering, p. 128271, 2013.
, “A study of the valence shell electronic states of pyridazine by photoabsorption spectroscopy and time-dependent density functional theory calculations”, Journal of Physics B-atomic Molecular and Optical Physics, vol. 46, p. 175103, 2013.
, “Supersolid structure and excitation spectrum of soft-core bosons in three dimensions”, Physical Review A, vol. 88, p. 033618, 2013.
, “Surface antiferromagnetism and incipient metal-insulator transition in strained manganite films”, Physical Review B, vol. 87, p. 214420, 2013.
, “Surface electronic structure of InSb(001)-c(8 x 2)”, Surface Science, vol. 608, pp. 22–30, 2013.
, “Surface Functionalization of Graphene”, Graphene Chemistry: Theoretical Perspectives, pp. 233–253, 2013.
, “Surface Octahedral Distortions and Atomic Design of Perovskite Interfaces”, Advanced Materials, vol. 25, pp. 4043–4048, 2013.
, “Surface pinning of catalyst nanoparticles for enhanced size and position control of 1D nanostructures growth”, Microelectronic Engineering, vol. 110, pp. 335–339, 2013.
, “Surface structure of nickel oxide layers on a Rh(111) surface”, Surface Science, vol. 611, pp. 86–93, 2013.
, “Surface structure of Pd(111) with less than half a monolayer of Zn”, Physical Chemistry Chemical Physics, vol. 15, pp. 12488–12494, 2013.
, “Synthesis and properties of highly metallic orbital-ordered A-site manganites”, Journal of Nanoparticle Research, vol. 15, p. 1655, 2013.
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