(Showing: 1 - 10 of 90)
(Showing: 1 - 90 of 90)
A. Barati Farimani, M. Heiranian and N. R. Aluru
"Nano-electro-mechanical pump: Giant pumping of water in carbon nanotubes"
Scientific Reports
, v.6
, 2016
, p.26211
S. De, K. Kunal and N. R. Aluru
"Mixed role of surface on intrinsic losses in silicon nanostructures"
Journal of Applied Physics
, v.119
, 2016
, p.114304
Y. Wu, L. K. Wagner and N. R. Aluru
"Hexagonal boron nitride and water interaction parameters"
Journal of Chemical Physics
, v.144
, 2016
, p.164118
A. Ashraf, Y. Wu, M. C. Wang, K. Yong, T. Sun, Y. Jing, R. T. Haasch, N. R. Aluru and S. Nam
"Doping-induced tunable wettability and adhesion of graphene"
Nano Letters
, v.16
, 2016
, p.4708
A. Barati Farimani and N. R. Aluru
"Existence of multiple phases of water at nanotube interfaces"
Journal of Physical Chemistry C
, v.120
, 2016
, p.23763
A. R. Damodaran, J. C. Agar, S. Pandya, Z. Chen, L. Dedon, R. Xu, B. Apgar, S. Saremi, L. W. Martin
"New modalities of strain-control of ferroelectric thin films (invited review)"
J. Phys. Condens. Matter
, v.28
, 2016
, p.263001
J. C. Agar, S. Pandya, R. Xu, A. K. Yadav, S. Saremi, T. Angsten, M. D. Asta, R. Ramesh, L. W. Martin
"Frontiers in multifunctional ferroic materials [invited prospective]"
MRS Commun.
, v.6
, 2016
, p.151
J. Feng, M. Graf, K. Liu, D. Ovchinnikov, D. Dumcenco, M. Heiranian, V. Nandigana, N. R. Aluru, A. Kis and A. Radenovic
"Single-layer MoS2 nanopores as nanopower generators"
Nature
, v.536
, 2016
, p.197
K. A. Kearney, A. A. Iyer, A. A. Rockett, A. Staykov, E. Ertekin
"Effect of Surface Coverage and ?Composition on the Stability and Interfacial Dipole of Functionalized Silicon"
J. Phys. Chem. C
, 2017
DOI: 10.1021/acs/jpcc.7b00791
L. R. Dedon, A. R. Damodaran, Z. Chen, S. Saremi, R. Gao, B. A. Apgar, L. W. Martin
"Stoichiometry control of domain structure and electronic, dielectric, and ferroelectric properties of BiFeO3 films"
Chem. Mater.
, v.28
, 2016
, p.5952
S. Saremi, R. Xu, L. R. Dedon, J. M. Mundy, S.-L. Hsu, Z. Chen, A. R. Damodaran, S. P. Chapman, J. T. Evans, L. W. Martin
"Enhanced electrical resistivity and properties via ion bombardment of ferroelectric thin films"
Adv. Mater.
, v.26
, 2016
, p.10750
T. Sanghi, R. Bhadauria and N. R. Aluru
"Memory effects in nanoparticle dynamics and transport"
Journal of Chemical Physics
, v.145
, 2016
, p.134108
Zachary Goldsmith, A. K. Harshan, J. B. Gerken, M. Voros, G. Galli, S. S. Stahl, S. Hammes-Schiffer
"Characterization of NiFe oxyhydroxide electrocatalysts by integrated electronic structure calculations and spectroelectrochemistry"
Proceedings of the National Academy of Sciences of the United States of America
, v.114
, 2017
, p.3050
A. Barati Farimani, P. Dibaeinia and N. R. Aluru
"DNA origami-graphene hybrid nanopore for DNA detection"
ACS Applied Materials & Interfaces
, v.9
, 2017
, p.92
A. R. Damodaran, S. Pandya, J. C. Agar, Y. Cao, R. K. Vasudevan, R. Xu, S. Saremi, Q. Li, J. Kim, M. R. McCarter, L. R. Dedon, T. Angsten, N. Balke, S. Jesse, M. Asta, S. V. Kalinin, L. W. Martin
"Three-state ferroelectric switching and large electromechanical responses in PbTiO3 thin films."
Adv. Mater.
, v.29
, 2017
, p.1702069
A. Radocea, T. Sun, T. H. Vo, A. Sinitskii, N. R. Aluru and J. W. Lyding
"Solution-synthesized chevron graphene nanoribbons exfoliated onto H:Si(100)"
Nano Letters
, v.17
, 2017
, p.170
Ashwathi I. Iyer, Kara Kearney, Shohei Wakayama, Hirotoshi Odoi, and Elif Ertekin
"Design strategy for the Molecular Functionalization of Semiconductor Photoelectrodes: A Case Study of p-Si(111) Photocathodes for H2 Generation"
Langmuir
, v.34
, 2018
, p.2959
K. Kearney, A. Rockett, and E. Ertekin
"Computational insights into charge transfer across functionalized semiconductor surfaces"
Science and Technology of Advanced Materials
, v.18
, 2017
, p.681
Kara Kearney, Ashwathi I. Iyer, Angus Rockett, Aleksandar Staykov, and Elif Ertekin
"Multiscale Computational Design of Functionalized Photocathodes for H2 Generation"
J. Am. Chem. Soc.
, v.140
, 2018
, p.50
L. R. Dedon, Z. Chen, R. Gao, Y. Qi, E. Arenholz, L. W. Martin
"Strain-driven phase competition near the antipolar-nonpolar phase boundary in Bi¬0.7¬La0.3FeO3 thin films"
ACS Appl. Mater. Inter.
, v.10
, 2018
, p.14914
M. Heiranian, Y. Wu and N. R. Aluru
"Molybdenum disulfide and water interaction parameters"
Journal of Chemical Physics
, v.147
, 2017
, p.104706
M. Mehdi Pour, A. Lashkov, A. Radocea, X. Liu, T. Sun, A. Lipatov, R. A. Korlacki, M. Shekhirev, N. R. Aluru, J. W. Lyding, V. Sysoev and A. Sinitskii
"Laterally extended atomically precise graphene nanoribbons with improved electrical conductivity for efficient gas sensing"
Nature Communications
, v.8
, 2017
, p.820
Namhoon Kim, Emily M. Turner, Yoonyoung Kim, Shintaro Ida, Hidehisa Hagiwara, Tatsumi Ishihara, and Elif Ertekin
"Two-Dimensional TiO2 Nanosheets for Photo and Electro-Chemical Oxidation of Water: Predictions of Optimal Dopant Species from First-Principles"
J. Phys. Chem C.
, v.121
, 2017
, p.19201
R. Bhadauria and N. R. Aluru
"Multiscale modeling of electroosmotic flow: Effects of discrete ion, enhanced viscosity, and surface friction"
Journal of Chemical Physics
, v.146
, 2017
, p.184106
R. Gao, S. E. Reyes-Lillo, R. Xu, A. Dasgupta, Y. Dong, L. R. Dedon, J. Kim, S. Saremi, Z. H. Chen, C. R. Serrao, H. Zhou, J. B. Neaton, L. W. Martin
"Ferroelectricity in Pb1+?ZrO3 thin films."
Chem. Mater.
, v.29
, 2017
, p.6544
R. Xu, R. Gao, S. E. Reyes-Lillo, S. Saremi, Y. Dong, H. Lu, Z. Chen, X. Lu, Y. Qi, S.-L. Hsu, A. R. Damodaran, H. Zhou, J. B. Neaton, L. W. Martin
"Reducing coercive-field scaling in ferroelectric thin films via orientational control"
ACS Nano
, v.12
, 2018
, p.4736
Railsback, J. G., Wang, H., Liu, Q., Lu, M. Y. & Barnett, S. A.
"Degradation of La0.6Sr0.4Fe0.8Co0.2O3-? Oxygen Electrodes on Ce0.9Gd0.1O3-? Electrolytes during Reversing Current Operation."
Journal of The Electrochemical Society
, v.164
, 2017
, p.F3083
doi:10.1149/2.0111710jes
S. Pandya, J. Wilbur, J. Kim, R. Gao, A. Dasgupta, C. Dames, L. W. Martin
"Pyroelectric energy conversion with large energy and power density in relaxor ferroelectric thin films"
Nature Mater.
, v.17
, 2018
, p.432
S. Saremi, A. Dasgupta, R. Gao, L. W. Martin
"New facets for the role of defects in ceramics [Invited feature, cover story]."
Am. Ceram. Soc. Bull.
, v.97
, 2018
, p.16
S. Saremi, R. Xu, L. R. Dedon, L. W. Martin
"Electronic transport and ferroelectric switching in ion-bombarded, defected-engineered BiFeO3 thin films"
Adv. Mater. Inter.
, v.5
, 2018
, p.1700991
S. Y. Mashayak and N. R. Aluru
"Langevin-Poisson-EQT: A dipolar solvent based quasi-continuum approach for electric double layers"
Journal of Chemical Physics
, v.146
, 2017
, p.044108
Shintaro Ida, Kenta Sato, Tetsuya Nagata, Hidehisa Hagiwara, Motonori Watanabe, Namhoon Kim, Yoshihito Shiota, Michio Koinuma, Sakae Takenaka, Takaki Sakai, Elif Ertekin, and Tatsumi Ishihara
"A Cocatalyst that Stabilizes a Hydride Intermediate during Photocatalytic Hydrogen Evolution over a Rhodium-Doped TiO2 Nanosheet"
Angewandte Chemie
, v.57
, 2018
, p.9073
Y. Jing, H. Matsumoto and N. R. Aluru
"Mechanistic Insights into Hydration of Solid Oxides"
Chemistry of Materials
, v.30
, 2018
, p.138
Y. Yang, T. Culpitt, and S. Hammes-Schiffer
"Multicomponent time-dependent density functional theory: Proton and electron excitation energies"
J. Phys. Chem. Lett.
, v.9
, 2018
, p.1765
Z. Chen, Z. Liu, Z. Chen, M. E. Holtz, C. Li, X. R. Wang, W. Lu, L. S. Fan, L. R. Dedon, C. Federick, R. Gao, R. Xu, A. T. N?Diaye, E. Arenholz, J. A. Mundy, T. Venkatesan, D. A. Muller, L.-W. Wang, J. Liu, L. W. Martin
"Electron accumulation and emergent magnetism in LaMnO3/SrTiO3 heterostructures."
Phys. Rev. Lett. 119, 156801 (2017).
, v.119
, 2017
, p.156801
Zhang, S.-L., Wang, H., Lu, M. Y., Zhang, A.-P., Mogni, L. V., Liu, Q., Li, C.-X., Li, C.-J. & Barnett, S. A.
"Cobalt-substituted SrTi0.3Fe0.7O3??: a stable high-performance oxygen electrode material for intermediate-temperature solid oxide electrochemical cells"
Energy & Environmental Science
, 2018
, p.doi:10.10
A. Barati Farimani, M. Heiranian and N. R. Aluru
"Identification of amino acids with sensitive nanoporous MoS2: towards machine learning-based prediction"
npj 2D Materials and Applications
, v.2
, 2018
, p.14
A. Dasgupta, S. Saremi, R. Xu, L. R. Dedon, S. Pandya, A. R. Damodaran, L. W. Martin
"Nonstoichiometry, structure, and properties of Ba1-xTiO3-y thin films."
J. Mater. Chem. C
, v.6
, 2018
, p.10751
A. Moradzadeh, M. H. Motevaselian, S. Y. Mashayak and N. R. Aluru
"Coarse-Grained Force Field for Imidazolium-Based Ionic Liquids"
Journal of Chemical Theory and Computation
, v.14
, 2018
, p.3252
B. Ouyang, T. Chakraborty, N.H. Kim, N.H. Perry, T. Mueller, N.R. Aluru, E. Ertekin
"A cluster expansion framework for the Sr(Ti1-xFex)O3-x/2 (0 x 1) mixed ionic electronic conductor: properties based on realistic configurations"
Chemistry of Materials
, 2019
10.1021/acs.chemmater.8b04285
D. R. Trinkle
"Variational Principle for Mass Transport"
Phys. Rev. Lett.
, v.121
, 2018
, p.235901
J. C. Agar, Y. Cao, B. Naul, S. Pandya, S. van der Walt, A. I. Luo, J. T. Maher, A. R. Damodaran, N. Balke, S. Jesse, S. V. Kalinin, R. K. Vasudevan, L. W. Martin
"Machine detection of enhanced electromechanical energy conversion in PbZr0.2Ti0.8O¬3¬ thin films"
Adv. Mater.
, v.30
, 2018
, p.1800701
J. Kim, Y. Qi, A. R. Damodaran, R. Gao, H. Takenaka, S. Pandya, M. R. McCarter, A. M. Rappe, L. W. Martin
"Epitaxial strain control of relaxor ferroelectric phase evolution."
Adv. Mater.
, v.31
, 2019
, p.1901060
J. S. Lim, J. H. Lee, R. Gao, T. Y. Koo, L. W. Martin, R. Ramesh, C.-H. Yang
"Ultrafast collective oxygen-vacancy flow in Ca-doped BiFeO3."
NPG Asia Mater.
, v.10
, 2018
, p.943
Kara Kearney, Gabseok Seo, Toshinori Matsushima, Chihaya Adachi, Elif Ertekin, and Angus Rockett
"Computational Analysis of the Interplay between Deep Level Traps and Perovskite Solar Cell Efficiency"
J. Am. Chem. Soc.
, v.140
, 2018
, p.15655
L. Ma, P. Priya and N. R. Aluru
"A Multiscale Model for Electrochemical Reactions in LSCF Based Solid Oxide Cells"
Journal of the Electrochemical Society
, v.165
, 2018
, p.F1232
M. H. Motevaselian, S. Y. Mashayak, and N. R. Aluru
"Extended coarse-grained dipole model for polar liquids: Application to bulk and confined water"
Physical Review E
, v.98
, 2018
, p.052135
M.Y. Lu, J.G. Railsback, H. Wang, Q. Liu, Y.A. Chart, S.-L. Zhang, S.A. Barnett
"Stable High Current Density Operation of La0.6Sr0.4Co0.2Fe0.8¬O3-? Oxygen Electrodes."
J. Mater. Chem. A
, v.7
, 2019
, p.13531
N. Kim, N.H. Perry, E. Ertekin
"Atomic Modeling and Electronic Structure of Mixed Ionic-Electronic Conductor SrTi1?xFexO3?x/2+? Considered as a Mixture of SrTiO3 and Sr2Fe2O5"
Chemistry of Materials
, 2019
10.1021/acs.chemmater.8b04284
Namhoon Kim, Nicola H. Perry, and Elif Ertekin
"Atomic Modeling and Electronic Structure of Mixed Ionic?Electronic Conductor SrTi1?xFexO3?x/2+? Considered as a Mixture of SrTiO3 and Sr2Fe2O5"
Chem. Mater.
, v.31
, 2019
, p.233
Nicola H. Perry, Namhoon Kim, Elif Ertekin, and Harry L. Tuller
"Origins and Control of Optical Absorption in a Nondilute Oxide Solid Solution: Sr(Ti,Fe)O3?x Perovskite Case Study"
Chem. Mater.
, v.31
, 2019
, p.1030
R. Xu, S. Liu, S. Saremi, R. Gao, H. Lu, J. J. Wang, Z. J. Hong, A. Ghosh, S. Pandya, E. Bonturim, Z. Chen, L.-Q. Chen, A. M. Rappe, L. W. Martin
"Kinetic control of tunable multi-state switching in ferroelectric thin films"
Nature Commun.
, v.10
, 2019
, p.1282
Ryan T. Pekarek, Kara Kearney, Benjamin M. Simon, Elif Ertekin, Angus A. Rockett, and Michael J. Rose
"Identifying Charge Transfer Mechanisms across Semiconductor Heterostructures via Surface Dipole Modulation and Multiscale Modeling"
J. Am. Chem. Soc.
, v.140
, 2018
, p.13223
S. Das, A. Ghosh, M. R. McCarter, S.-L. Hsu, Y.L. Tang, A. R. Damodaran, R. Ramesh, L. W. Martin
"Perspective: Emergent topologies in oxide superlattices."
APL Mater.
, v.6
, 2018
, p.100901
S. Mashayak and N. R. Aluru
"A multiscale model for charge inversion in electric double layers"
Journal of Chemical Physics
, v.148
, 2018
, p.214102
S. Mashayak, L. Miao and N. R. Aluru
"Integral equation theory based direct and accelerated systematic coarse-graining approaches"
Journal of Chemical Physics
, v.148
, 2018
, p.214105
S. Pandya, G. A. Velarde, R. Gao, A. Everhardt, R. Xu, J. T. Maher, J. C. Agar, L. W. Martin
"Understanding the role of ferroelastic domains on the pyroelectric and electrocaloric effects in ferroelectric thin films"
Adv. Mater.
, v.31
, 2019
, p.1803312
S. Pandya, G. Velarde, L. Zhang, J. Wilbur, A. Smith, B. Hanrahan, C. Dames, L. W. Martin
"New approaches to waste-heat energy harvesting ? Pyroelectric energy conversion"
NPG Asia Mater.
, v.11
, 2019
, p.26
S. Saremi, R. Xu, F. Allen, J. Maher, J. C. Agar, P. Hosemann, L. W. Martin
"Local control of defects and switching properties in ferroelectric thin films"
Phys. Rev. Mater.
, v.2
, 2018
, p.084414
S. Zhang, H. Wang, M.Y. Lu, C.-X. Li, C.-J. Li, S.A. Barnett
"Electrochemical Performance and Stability of SrTi0.3Fe0.6Co0.1O3-? Infiltrated La0.8Sr0.2MnO3-Zr0.92Y0.16O2-? Oxygen Electrodes for Intermediate-Temperature Solid Oxide Electrochemical Cells"
J. Power Sources
, v.426
, 2019
, p.233
T. Chen, G.F. Harrington, J. Matsuda, K. Sasaki, D. Pham, E.L. Corral, and N.H. Perry
"Modifying Grain Boundary Ionic/Electronic Transport in Nano-Sr- and Mg- Doped LaGaO3-? by Sintering Variations"
Journal of the Electrochemical Society
, v.166
, 2019
, p.F569
Y. Takamura, K. Leonard, A. Luo, L. W. Martin, H. Matsumoto
"Platinum nanoparticle induced nanoionics effects on electrical conduction in strontium cerate and zirconate"
J. Sol. Stat. Electrochem.
, v.23
, 2019
, p.953
A. Moradzadeh and N. R. Aluru
"Molecular Dynamics Properties without the Full Trajectory: A Denoising Autoencoder Network for Properties of Simple Liquids"
Journal of Physical Chemistry Letters
, v.10
, 2019
, p.7568
10.1021/acs.jpclett.9b02820
A. Moradzadeh and N. R. Aluru
"Transfer-Learning-Based Coarse-Graining Method for Simple Fluids: Toward Deep Inverse Liquid-State Theory"
Journal of Physical Chemistry Letters
, v.10
, 2019
, p.1242
10.1021/acs.jpclett.8b03872
E. Lupi, A. Ghosh, S. Saremi, S. Pandya, G. Velarde, A. Fernandez, L. W. Martin
"Large polarization and susceptibilities in artificial morphotropic phase boundary PbZr1-xTixO3 superlattices"
Adv. Electron. Mater.
, 2020
, p.1901395
10.1002/aelm.201901395
J. Kim, M. Acharya, S. Saremi, G. Velarde, E. Parsonnet, P. Donahue, A. Qualls, D. Garcia, L. W. Martin
"Ultrahigh capacitive energy density in ion-bombard relaxor ferroelectric films"
Science
, v.369
, 2020
, p.81
10.1126/science.abb0631
M. Asadi, M. H. Motevaselian, A. Moradzadeh, L. Majidi, M. Esmaeilirad, T. Sun, C. Liu, R. Bose, P. Abbasi, P. Zapol, A. P. Khodadoust, L. A. Curtiss, N. R. Aluru, A. Salehi-Khojin
"Highly Efficient Solar-Driven Carbon Dioxide Reduction on Molybdenum Disulfide Catalyst Using Choline Chloride-Based Electrolyte"
Advanced Energy Materials
, v.9
, 2019
, p.1803536
10.1002/aenm.201803536
M.Y. Lu, R. Scipioni, B.-K. Park, T. Yang, Y.A. Chart and S.A. Barnett
"Mechanisms of PrOx performance enhancement of oxygen electrodes for low and intermediate temperature solid oxide fuel cells"
Materials Today Energy
, 2019
10.1016/j.mtener.2019.100362
R. Gao, S. Pandya, Y. Dong, H. Zhao, A. I. Luo, L. R. Dedon, V. Thoreton, R. Xu, S. Saremi, T. Chen, A. Jain, T. Ishihara, D. R. Trinkle, N. H. Perry, L. W. Martin
"Designing optimal perovskite structure for high ionic conduction"
Adv. Mater.
, v.32
, 2020
, p.1905178
10.1002/adma.201905178
T. Fujisaki, A. T. Staykov, Y. H. Jing, K. Leonard, N. R. Aluru, H. Matsumoto
"Understanding the effect of Ce and Zr on chemical expansion in yttrium doped strontium cerate and zirconate by high temperature X-ray analysis and density functional theory"
Solid State Ionics
, v.333
, 2019
, p.1
10.1016/j.ssi.2019.01.009
T.A. Schmauss, J.G. Railsback, M.Y. Lu, K.Y. Zhao and S.A. Barnett
"ZrO2 atomic layer deposition into Sr0.5Sm0.5CoO3???Ce0.9Gd0.1O2?? solid oxide fuel cell cathodes: mechanisms of stability enhancement"
Journal of Materials Chemistry A
, 2019
10.1039/c9ta09214e
Y. Jing and N. R. Aluru
"The role of A-site ion on proton diffusion in perovskite oxides (ABO3)"
Journal of Power Sources
, v.445
, 2020
, p.227327
10.1016/j.jpowsour.2019.227327
C. Choi, J. Leem, M. S. Kim, A. Taqieddin, C. Cho, K. W. Cho, G. J. Lee, H. Seung, H. J. Bae, Y. M. Song, T. Hyeon, N. R. Aluru, S. W. Nam, D.-H. Kim
"Curved neuromorphic image sensor array using a MoS2-organic heterostructure inspired by the human visual recognition system"
Nature Communications
, v.11
, 2020
, p.5934
10.1038/s41467-020-19806-6
J. Kim, D. J. Meyers, A. Kumar, A. Fernandez, G. A. P. Velarde, Z. Tian, J.-W. Kim, J. M. LeBeau, P. J. Ryan, L. W. Martin
"Frequency-dependent suppression of polarization rotation in relaxor ferroelectric thin films"
Matter
, v.4
, 2021
, p.2367
10.1016/j.matt.2021.04.017
M. H. Motevaselian and N. R. Aluru
"Confinement-Induced Enhancement of Parallel Dielectric Permittivity: Super Permittivity Under Extreme Confinement"
Journal of Physical Chemistry Letters
, v.11
, 2020
, p.10532
10.1021/acs.jpclett.0c03219
M. H. Motevaselian and N. R. Aluru
"Universal Reduction in Dielectric Response of Confined Fluids"
ACS Nano
, v.14
, 2020
, p.12761
10.1021/acsnano.0c03173
M. Heiranian, Y. Noh, and N. R. Aluru
"Dynamic and weak electric double layers in ultrathin nanopores"
Journal of Chemical Physics
, v.154
, 2021
, p.134703
10.1063/5.0048011
M.Y. Lu, T. Yang, R. Scipioni, Y.A. Chart, A. Furlong and S.A. Barnett
"Sm0.5Sr0.5CoO3?? Surface Modification of La0.6Sr0.4Co0.2Fe0.8O3??-Ce0.9Gd0.12?? Composite Oxygen Electrodes for Solid Oxide Electrochemical Cells"
Journal of the Electrochemical Society
, v.167
, 2020
, p.164504
10.1149/1945-7111/abca6f
P. Priya and N. R. Aluru
"A multiscale framework to predict electrochemical characteristics of yttrium doped Barium Zirconate based solid oxide cells"
Journal of Power Sources
, v.481
, 2021
, p.228969
10.1016/j.jpowsour.2020.228969
P. Priya, N. R. Aluru
"Accelerated design and discovery of perovskites with high conductivity for energy applications through machine learning"
npj Computational Materials
, v.7
, 2021
, p.90
10.1038/s41524-021-00551-3
R. Gao*, A. Fernandez*, T. Chakraborty, A. Luo, D. Pesquera, S. Das, G. Velarde, V. Thoreton, J. Kilner, T. Ishihara, S. Nemsak, E. J. Crumlin, E. Ertekin, L. W. Martin
"Correlating surface crystal orientation and gas kinetics in perovskite-oxide electrodes"
Adv. Mater.
, v.33
, 2021
, p.2100977
10.1002/adma.202100977
S. Chen, S. Yuan, Z. Hou, Y. Tang, J. Zhang, T. Wang, K. Li, W. Zhao, X. Liu, L. Chen, L. W. Martin, Z. Chen
"Recent progress on topological structures in ferroic thin films and heterostructures"
Adv. Mater.
, v.33
, 2021
, p.200857
10.1002/adma.202000857
Y. Noh and N. R. Aluru
"Ion Transport in Electrically Imperfect Nanopores"
ACS Nano
, v.14
, 2020
, p.10518
10.1021/acsnano.0c04453
Naheed Ferdous, Elif Ertekin
"Strontium ruthenate - anatase titanium dioxide heterojunctions from first-principles: electronic structure, spin, and interface dipoles"
Journal of Applied Physics
, v.120
, 2016
, p.035302
Bin Ouyang, Tanmoy Chakraborty, Namhoon Kim, Nicola H. Perry, Tim Mueller, Narayana R. Aluru, and Elif Ertekin
"Cluster Expansion Framework for the Sr(Ti1?xFex)O3?x/2 (0 < x < 1) Mixed Ionic Electronic Conductor: Properties Based on Realistic Configurations"
Chem. Mater.
, v.31
, 2019
, p.3144
Ashwathi A. Iyer and Elif Ertekin
"Asymmetric response of ferroelectric/metal oxide heterojunctions for catalysis arising from interfacial chemistry"
Phys. Chem. Chem. Phys.
, v.19
, 2017
, p.5870
Yang, Yang and Culpitt, Tanner and Tao, Zhen and Hammes-Schiffer, Sharon
"Stability conditions and local minima in multicomponent Hartree-Fock and density functional theory"
The Journal of Chemical Physics
, v.149
, 2018
10.1063/1.5040353
Citation Details
S. Zhou, K. S. Panse, M. H. Motevaselian, N. R. Aluru, Y. Zhang
"Three-Dimensional Molecular Mapping of Ionic Liquids at Electrified Interfaces"
ACS Nano
, v.14
, 2020
, p.17515
10.1021/acsnano.0c07957
A. Moradzadeh, N. R. Aluru
"Understanding simple liquids through statistical and deep learning approaches"
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10.1063/5.0046226
R. Bhadauria and N. R. Aluru
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