Zobrazeno 1 - 10
of 25
pro vyhledávání: '"Victor Krayzman"'
Publikováno v:
Chemistry of Materials. 34:9989-10002
Publikováno v:
Journal of Applied Crystallography. 53:1509-1518
Reported here are the development and application of new capabilities in the RMCProfile software for structural refinements using the reverse Monte Carlo (RMC) method. An algorithm has been implemented to enable the use of arbitrary peak-shape functi
Autor:
Eric Cockayne, Lawrence H. Friedman, Gavin Vaughan, Larissa Y. Kunz, Igor Levin, Aaron C. Johnston-Peck, Victor Krayzman, Matteo Cargnello, Andrew J. Allen, Fan Zhang
Publikováno v:
Chemistry of Materials. 32:286-298
Structural refinements of whole-nanoparticle atomistic models using X-ray total-scattering data and the reverse Monte Carlo algorithm were demonstrated for mixtures of TiO2 brookite nanorods and ir...
Autor:
Karena W. Chapman, Igor Levin, Helen Y. Playford, Alexei Bosak, Joseph C. Woicik, Bruce Ravel, M. Eremenko, Victor Krayzman
Publikováno v:
Nature Communications, Vol 10, Iss 1, Pp 1-9 (2019)
'Nature Communications ', vol: 10, pages: 2728-1-2728-9 (2019)
Nature Communications
'Nature Communications ', vol: 10, pages: 2728-1-2728-9 (2019)
Nature Communications
The development of useful structure-function relationships for materials that exhibit correlated nanoscale disorder requires adequately large atomistic models which today are obtained mainly via theoretical simulations. Here, we exploit our recent ad
Autor:
M. Eremenko, Victor Krayzman, Helen Y. Playford, Ian M. Reaney, Giannantonio Cibin, Igor Levin, William J. Laws, Dean S. Keeble
Publikováno v:
Chemistry of Materials. 31:2450-2458
K0.5Bi0.5TiO3 (KBT)—one of the few perovskite-like ferroelectric compounds with room-temperature tetragonal symmetry—differs from other members of its family (BaTiO3 and PbTiO3) by the presence of ...
Autor:
Matthew G. Tucker, Karena W. Chapman, R. L. Paul, Victor Krayzman, Giannantonio Cibin, M. Eremenko, Igor Levin
Publikováno v:
Scientific Reports, Vol 7, Iss 1, Pp 1-8 (2017)
Perovskite potassium sodium niobates, K1−xNaxNbO3, are promising lead-free piezoelectrics. Their dielectric and piezoelectric characteristics peak near x = 0.5, but the reasons for such property enhancement remain unclear. We addressed this uncerta
Publikováno v:
Journal of Applied Crystallography. 50:1561-1570
Over the past decade, the RMCProfile software package has evolved into a powerful computational framework for atomistic structural refinements using a reverse Monte Carlo (RMC) algorithm and multiple types of experimental data. However, realizing the
Autor:
Cindi L. Dennis, Helen Y. Playford, Matthew G. Tucker, Monika Tomczyk, Paula M. Vilarinho, Igor Levin, Terrell A. Vanderah, Joseph C. Woicik, Victor Krayzman, Hui Wu
Publikováno v:
Journal of Solid State Chemistry. 246:29-41
Hexagonal manganates RMnO 3 (R=Y, Ho, Dy) have been recently shown to exhibit oxygen-storage capacities promising for three-way catalysts, air-separation, and related technologies. Here, we demonstrate that Ti substitution for Mn can be used to chemi
Autor:
Joseph C. Woicik, M. Eremenko, Zhilun Lu, Matthew G. Tucker, Igor Levin, A. Bruma, Helen Y. Playford, Victor Krayzman, Russell A. Maier
Publikováno v:
Acta Materialia. 207:116678
Local distortions in perovskite-like A-site-deficient (Sr,La)TiO3 solid solutions have been determined by refining large-scale atomic configurations against neutron/X-ray total-scattering and extended-X-ray-absorption-fine-structure data. Structural
Autor:
Jacob L. Jones, Frank Bridges, Tedi-Marie Usher, Joseph C. Woicik, Victor Krayzman, Igor Levin, George E. Sterbinsky, D. Torrejon
Publikováno v:
Physical Review B. 93
Local structures in cubic perovskite-type $(\mathrm{B}{\mathrm{a}}_{0.6}\mathrm{B}{\mathrm{i}}_{0.4})(\mathrm{T}{\mathrm{i}}_{0.6}\mathrm{S}{\mathrm{c}}_{0.4}){\mathrm{O}}_{3}$ solid solutions that exhibit reentrant dipole glass behavior have been st