Half-Heusler semiconductors as piezoelectrics

Karin M. Rabe , David Vanderbilt , Joseph W. Bennett , Anindya Roy
Bulletin of the American Physical Society 2012

178
2012
Methane Dissociation on α-Fe₂O₃(0001) and Fe₃O₄(111) Surfaces: First-Principles Insights into Chemical Looping Combustion

David M. Cwiertny , Vicki H. Grassian , Sara E. Mason , Joseph W. Bennett
The Journal of Physical Chemistry

2019
Density functional theory and thermodynamics analysis of MAl12 Keggin substitution reactions: Insights into ion incorporation and experimental confirmation

Tori Z. Forbes , Sara E. Mason , Joseph W. Bennett , Jennifer L. Bjorklund
Journal of Chemical Physics 154 ( 6) 064303 -064303

2021
A density functional theory (DFT) investigation of how small molecules and atmospheric pollutants relevant to art conservation adsorb on kaolinite

Joseph W. Bennett , Ryan T. Grimes , Zeev Rosenzweig , Jessica E. Heimann
Applied Clay Science 206 106075

5
2021
Nonmonotonic Composition Dependence of the Dielectric Response of Ba1-xCaxZrO3

Joseph W. Bennett , Ilya Grinberg , Andrew M. Rappe
Chemistry of Materials 20 ( 16) 5134 -5138

11
2008
Pseudopotentials for high-throughput DFT calculations

Kevin F. Garrity , Joseph W. Bennett , Karin M. Rabe , David Vanderbilt
Computational Materials Science 81 446 -452

1,153
2014
First-principles study of band gap engineering via oxygen vacancy doping in perovskite A B B ′ O 3 solid solutions

Tingting Qi , Matthew T. Curnan , Seungchul Kim , Joseph W. Bennett
Physical Review B 84 ( 24) 245206

30
2011
187
2009
New Prospects for High Performance SONAR, Chemical Sensor, and Communication Device Materials

Tingting Qi , Sergey V. Levchenko , Joseph W. Bennett , Ilya Grinberg
ieee international conference on high performance computing data and analytics 197 -204

1
2009
Studies of Perovskite Materials for High-Performance Storage Media, Piezoelectric, and Solar Energy Conversion Devices

Tingting Qi , Ilya Grinberg , Joseph W. Bennett , Young-Han Shin
ieee international conference on high performance computing data and analytics 249 -258

4
2010
Influence of nickel manganese cobalt oxide nanoparticle composition on toxicity toward Shewanella oneidensis MR-1: redesigning for reduced biological impact

Ian L. Gunsolus , Mimi N. Hang , Natalie V. Hudson-Smith , Joseph T. Buchman
Environmental science. Nano 4 ( 3) 636 -646

34
2017
Modeling of MAl12 Keggin Heteroatom Reactivity by Anion Adsorption

Jennifer L. Bjorklund , Joseph W. Bennett , Tori Z. Forbes , Sara E. Mason
Crystal Growth & Design 19 ( 5) 2820 -2829

11
2019
Antiferroelectric Topological Insulators in Orthorhombic AMgBi Compounds (A=Li, Na, K).

Bartomeu Monserrat , Joseph W. Bennett , Karin M. Rabe , David Vanderbilt
Physical Review Letters 119 ( 3) 036802

12
2017
Effect of symmetry lowering on the dielectric response of BaZrO 3

Joseph W. Bennett , Ilya Grinberg , Andrew M. Rappe
Physical Review B 73 ( 18) 180102

68
2006
Surface Transformations of Lead Oxides and Carbonates Using First-Principles and Thermodynamics Calculations.

Ryan T. Grimes , Joshua A. Leginze , Robert Zochowski , Joseph W. Bennett
Inorganic Chemistry 60 ( 2) 1228 -1240

2021
Research highlights: comparing the biological response of nanoparticle solid solutions

Joseph W. Bennett , Caley Allen , Sunipa Pramanik , Miranda J. Gallagher
Environmental science. Nano 4 ( 7) 1428 -1432

2017
Density functional theory study of hypotheticalPbTiO3-based oxysulfides

John A. Brehm , Hiroyuki Takenaka , Chan-Woo Lee , Ilya Grinberg
Physical Review B 89 ( 19) 195202

28
2014
Ab Initio Atomistic Thermodynamics Study of the (001) Surface of LiCoO2 in a Water Environment and Implications for Reactivity under Ambient Conditions

Xu Huang , Joseph W. Bennett , Mimi N. Hang , Elizabeth D. Laudadio
Journal of Physical Chemistry C 121 ( 9) 5069 -5080

12
2017
30
2018