Metastable states in the triangular-lattice Ising model studied by Monte Carlo simulations: Application to the spin-chain compound Ca[subscript 3]Co[subscript 2]O[subscript 6]

by Soto, R., Martinez, G., Baibich, M. N., Florez Uribe, Juan Manuel, Vargas, P.
Published 2011

Measurement of an Exceptionally Weak Electron-Phonon Coupling on the Surface of the Topological Insulator Bi[subscript 2]Se[subscript 3] Using Angle-Resolved Photoemission Spectros...

by Pan, Z. -H, Fedorov, A. V., Gardner, Dillon Richard, Lee, Young S., Chu, S., Valla, T.
Published 2012

Substantial reduction of Stone-Wales activation barrier in fullerene

by Kabir, Mohammad Mukul, Mukherjee, Swarnakamal, Saha-Dasgupta, Tanusri
Published 2012

Analytical homogenization method for periodic composite materials

by Chen, Ying, Schuh, Christopher A.
Published 2010

Koopmans' condition for density-functional theory

by Dabo, Ismaila, Ferretti, Andrea, Poilvert, Nicolas, Li, Yanli, Marzari, Nicola
Published 2011

Unfolding of collapsed polymers in shear flow: Effects of colloid banding structures in confining channels

by Chen, Hsieh, Alexander-Katz, Alfredo
Published 2014

Oxygen-vacancy tuning of magnetism in SrTi₀₇₅Fe₀₁₂₅Co₀₁₂₅O₃-[delta] perovskite

by Opazo, M. A., Ong, S. P., Florez, J. M., Vargas, Philip, Ross, Caroline A, Florez Uribe, Juan Manuel
Published 2019

Atomistic Oxidation Mechanism of a Carbon Nanotube in Nitric Acid

by Kanai, Yosuke, Khalap, Vaikunth R., Collins, Philip G., Grossman, Jeffrey C.
Published 2010

Tailoring the Asymmetric Magnetoimpedance Response in Exchange-Biased

by Kilic, U., Garcia, C., Ross, Caroline A
Published 2018

Hysteresis from Multiscale Porosity: Modeling Water Sorption and Shrinkage in Cement Paste

by Pinson, Matthew B., Masoero, Enrico, Bonnaud, Patrick A., Manzano, Hegoi, Ji, Qing, Yip, Sidney, Thomas, Jeffrey J., Bazant, Martin Z., Van Vliet, Krystyn J., Jennings, Hamlin Manson
Published 2015

Thermodynamic and kinetic properties of the Li-graphite system from first-principles calculations

by Ceder, Gerbrand, Persson, Kristin A., Hinuma, Yoyo, Meng, Ying Shirley, Van der Ven, Anton
Published 2011

Controlling chemical oscillations in heterogeneous Belousov-Zhabotinsky gels via mechanical strain

by Yashin, Victor V., Van Vliet, Krystyn J., Balazs, Anna C.
Published 2010

Effective transport properties of random composites: Continuum calculations versus mapping to a network

by Chen, Ying, Schuh, Christopher A.
Published 2010

Optoelectronic Properties in Monolayers of Hybridized Graphene and Hexagonal Boron Nitride

by Bernardi, Marco, Palummo, Maurizia, Grossman, Jeffrey C.
Published 2012

Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties

by Xie, Tian, Grossman, Jeffrey C.
Published 2018

Formation, migration, and clustering of delocalized vacancies and interstitials at a solid-state semicoherent interface

by Kolluri, Kedarnath, Demkowicz, Michael J.
Published 2012

Calibrating transition-metal energy levels and oxygen bands in first-principles calculations: Accurate prediction of redox potentials and charge transfer in lithium transition-meta...

by Seo, Dong-Hwa, Urban, Alexander, Ceder, Gerbrand
Published 2015

Mechanical instability of electrode-electrolyte interfaces in solid-state batteries

by Bucci, Giovanna, Talamini, Brandon Louis, Renuka Balakrishna, Ananya, Chiang, Yet-Ming, Carter, W Craig
Published 2018

Finding and proving the exact ground state of a generalized Ising model by convex optimization and MAX-SAT

by Urban, Alexander, Luo, Chuan, Huang, Wenxuan, Kitchaev, Daniil Andreevich, Dacek, Stephen Thomas, Cao, Shan, Ceder, Gerbrand, Rong, Ziqin
Published 2016

Ambient-pressure CVD of graphene on low-index Ni surfaces using methane: A combined experimental and first-principles study

by Olmos-Asar, Jimena A., Negreiros, Fabio R., Kim, Ki Kang, Kong, Jing, Mankey, Gary J., Araujo, Paulo T., Mafra, Daniela Lopes, Dresselhaus, Mildred, Reina Cecco, Alfonso
Published 2018