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Physical Chemistry Chemical Physics : PCCP|February 25, 2016
Correction: Ab initio and empirical defect modeling of LaMnO3±δ for solid oxide fuel cell cathodesYueh-Lin Lee, Shenzhen Xu, Dane MorganPhysical Chemistry Chemical Physics : PCCP|January 25, 2012
Cation interdiffusion model for enhanced oxygen kinetics at oxide heterostructure interfacesMilind J Gadre, Yueh-Lin Lee, Dane MorganThe Journal of Physical Chemistry. A|February 7, 2020
Density Functional Theory Study of the Gas Phase and Surface Reaction Kinetics for the MOVPE Growth of GaAs<sub>1-</sub>Bi<i></i>Ryan C Lucas, Dane Morgan, Thomas F KuechThe Journal of Chemical Physics|February 4, 2024
How close are the classical two-body potentials to ab initio calculations? Insights from linear machine learning based force matchingZheng Yu, Ajay Annamareddy, Dane Morgan, et al.Physical Review Letters|July 16, 2022
Understanding the Fragile-to-Strong Transition in Silica from Microscopic DynamicsZheng Yu, Dane Morgan, M D Ediger, et al.Physical Review Letters|October 29, 2013
Amorphization driven by defect-induced mechanical instabilityChao Jiang, Ming-Jie Zheng, Dane Morgan, et al.Nature Materials|July 18, 2006
Predicting crystal structure by merging data mining with quantum mechanicsChristopher C Fischer, Kevin J Tibbetts, Dane Morgan, et al.The Journal of Physical Chemistry Letters|May 10, 2016
Oxygen Point Defect Chemistry in Ruddlesden-Popper Oxides (La1-xSrx)2MO4±δ (M = Co, Ni, Cu)Wei Xie, Yueh-Lin Lee, Yang Shao-Horn, et al.Physical Review Letters|October 4, 2003
Predicting crystal structures with data mining of quantum calculationsStefano Curtarolo, Dane Morgan, Kristin Persson, et al.Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials|August 25, 2020
The incommensurately modulated structures of low-temperature labradorite feldspars: a single-crystal X-ray and neutron diffraction studyShiyun Jin, Huifang Xu, Xiaoping Wang, et al.Pageof 7