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Research Output 1972 2020

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2017
10 Citations (Scopus)

A(II)GeTeO6 (A = Mn, Cd, Pb): Non-Centrosymmetric Layered Tellurates with PbSb2O6-Related Structure

Kim, S. W., Deng, Z., Yu, S., Padmanabhan, H., Zhang, W., Gopalan, V., Jin, C. & Greenblatt, M., Aug 7 2017, In : Inorganic chemistry. 56, 15, p. 9019-9024 6 p.

Research output: Contribution to journalArticle

Cations
cations
Magnetic variables measurement
Harmonic generation
Powders
7 Citations (Scopus)

Accessing Forbidden Glass Regimes through High-Pressure Sub-Tg Annealing

Svenson, M. N., Mauro, J. C., Rzoska, S. J., Bockowski, M. & Smedskjaer, M. M., Apr 18 2017, In : Scientific reports. 7, 46631.

Research output: Contribution to journalArticle

Hardness
Glass
Pressure
Hot Temperature
Transition Temperature
12 Citations (Scopus)

A Cholecystokinin B Receptor-Specific DNA Aptamer for Targeting Pancreatic Ductal Adenocarcinoma

Clawson, G. A., Abraham, T., Pan, W., Tang, X., Linton, S. S., McGovern, C. O., Loc, W. S., Smith, J. P., Butler, P. J., Kester, M., Adair, J. H. & Matters, G. L., Feb 2017, In : Nucleic Acid Therapeutics. 27, 1, p. 23-35 13 p.

Research output: Contribution to journalArticle

Nucleotide Aptamers
Cholecystokinin B Receptor
Adenocarcinoma
Confocal microscopy
GTP-Binding Proteins
8 Citations (Scopus)

A Comparison of Fourier Spectral Iterative Perturbation Method and Finite Element Method in Solving Phase-Field Equilibrium Equations

Song, P., Yang, T., Ji, Y., Wang, Z., Yang, Z., Chen, L. & Chen, L., May 1 2017, In : Communications in Computational Physics. 21, 5, p. 1325-1349 25 p.

Research output: Contribution to journalArticle

equilibrium equations
finite element method
perturbation
mesh
boundary conditions
4 Citations (Scopus)

A curved pathway for oxygen interstitial diffusion in aluminum

Ross, A. J., Fang, H. Z., Shang, S., Lindwall, G. & Liu, Z., Dec 1 2017, In : Computational Materials Science. 140, p. 47-54 8 p.

Research output: Contribution to journalArticle

Aluminum
Diffusion Coefficient
Oxygen
Pathway
interstitials

Additively patterned ferroelectric thin films with vertical sidewalls

Welsh, A. J., Dezest, D., Nicu, L. & Trolier-McKinstry, S., Mar 1 2017, In : Journal of the American Ceramic Society. 100, 3, p. 848-858 11 p.

Research output: Contribution to journalArticle

Ferroelectric thin films
Printing
Silicon
Thin films
Remanence
64 Citations (Scopus)

Additive manufacturing of a functionally graded material from Ti-6Al-4V to Invar: Experimental characterization and thermodynamic calculations

Bobbio, L. D., Otis, R. A., Borgonia, J. P., Dillon, R. P., Shapiro, A. A., Liu, Z. K. & Beese, A. M., Apr 1 2017, In : Acta Materialia. 127, p. 133-142 10 p.

Research output: Contribution to journalArticle

3D printers
Functionally graded materials
Thermodynamics
Fabrication
Chemical analysis
4 Citations (Scopus)

Adhesion and diffusion at TiN/TiO2 interfaces: A first principles study

Martinez, J., Sinnott, S. B. & Phillpot, S. R., Apr 1 2017, In : Computational Materials Science. 130, p. 249-256 8 p.

Research output: Contribution to journalArticle

TiO2
First-principles
Adhesion
adhesion
Energy barriers
8 Citations (Scopus)

Adhesion of organic molecules on silica surfaces: A density functional theory study

McKenzie, M. E., Goyal, S., Lee, S. H., Park, H. H., Savoy, E., Rammohan, A. R., Mauro, J., Kim, H., Min, K. & Cho, E., Jan 1 2017, In : Journal of Physical Chemistry C. 121, 1, p. 392-401 10 p.

Research output: Contribution to journalArticle

Silicon Dioxide
Density functional theory
adhesion
Adhesion
Silica
40 Citations (Scopus)

Adsorption-controlled growth of La-doped BaSnO3 by molecular-beam epitaxy

Paik, H., Chen, Z., Lochocki, E., Ariel Seidner, H., Verma, A., Tanen, N., Park, J., Uchida, M., Shang, S., Zhou, B. C., Brützam, M., Uecker, R., Liu, Z. K., Jena, D., Shen, K. M., Muller, D. A. & Schlom, D. G., Nov 1 2017, In : APL Materials. 5, 11, 116107.

Research output: Contribution to journalArticle

Molecular beam epitaxy
Adsorption
Defects
Electron mobility
Point defects
7 Citations (Scopus)

A flexible, high-performance magnetoelectric heterostructure of (001) oriented Pb(Zr0.52Ti0.48)O3 film grown on Ni foil

Palneedi, H., Yeo, H. G., Hwang, G. T., Annapureddy, V., Kim, J. W., Choi, J. J., Trolier-McKinstry, S. & Ryu, J., Sep 1 2017, In : APL Materials. 5, 9, 096111.

Research output: Contribution to journalArticle

Metal foil
Heterojunctions
Texturing
Compressive stress
Ferroelectric materials
5 Citations (Scopus)

A hybrid functional study of native point defects in Cu2SnS3: Implications for reducing carrier recombination

Guan, P. W. & Liu, Z. K., Jan 1 2017, In : Physical Chemistry Chemical Physics. 20, 1, p. 256-261 6 p.

Research output: Contribution to journalArticle

Point defects
point defects
Defects
defects
energy of formation
23 Citations (Scopus)

Air and thermally stable perovskite solar cells with CVD-graphene as the blocking layer

Hu, X., Jiang, H., Li, J., Ma, J., Yang, D., Liu, Z., Gao, F. & Liu, S., Jun 28 2017, In : Nanoscale. 9, 24, p. 8274-8280 7 p.

Research output: Contribution to journalArticle

Graphite
Graphene
Chemical vapor deposition
Perovskite
Air
35 Citations (Scopus)

A lightweight single-phase AlTiVCr compositionally complex alloy

Qiu, Y., Hu, Y. J., Taylor, A., Styles, M. J., Marceau, R. K. W., Ceguerra, A. V., Gibson, M. A., Liu, Z. K., Fraser, H. L. & Birbilis, N., Jan 15 2017, In : Acta Materialia. 123, p. 115-124 10 p.

Research output: Contribution to journalArticle

Atoms
Density functional theory
Tomography
Structural properties
Enthalpy
3 Citations (Scopus)

A methodology for the accurate measurement of uniaxial compressive creep of refractory ceramics

Longhin, M. E., Shelleman, D. L. & Hellmann, Jr., J. R., Dec 1 2017, In : Measurement: Journal of the International Measurement Confederation. 111, p. 69-83 15 p.

Research output: Contribution to journalArticle

refractories
Refractory materials
Creep
methodology
ceramics
21 Citations (Scopus)

A microcube-based hybrid piezocomposite as a flexible energy generator

Zhang, Y., Zhu, W., Jeong, C. K., Sun, H., Yang, G., Chen, W. & Wang, Q., Jan 1 2017, In : RSC Advances. 7, 52, p. 32502-32507 6 p.

Research output: Contribution to journalArticle

Metals
Energy harvesting
Composite materials
Open circuit voltage
Perovskite
7 Citations (Scopus)

A modeling comparison between a two-stage and three-stage cascaded thermoelectric generator

Kanimba, E., Pearson, M., Sharp, J., Stokes, D., Priya, S. & Tian, Z., Jan 1 2017, In : Journal of Power Sources. 365, p. 266-272 7 p.

Research output: Contribution to journalArticle

thermoelectric generators
Temperature
lead tellurides
thermoelectric materials
Lead
118 Citations (Scopus)

An improved prediction of residual stresses and distortion in additive manufacturing

Mukherjee, T., Zhang, W. & DebRoy, T., Jan 1 2017, In : Computational Materials Science. 126, p. 360-372 13 p.

Research output: Contribution to journalArticle

3D printers
Residual Stress
residual stress
Residual stresses
manufacturing
2 Citations (Scopus)

An improved sampling strategy for global energy minimization of multi-component systems

Otis, R., Emelianenko, M. & Liu, Z. K., Apr 1 2017, In : Computational Materials Science. 130, p. 282-291 10 p.

Research output: Contribution to journalArticle

random sampling
Global Minimization
Multicomponent Systems
Sampling Strategy
Energy Minimization
18 Citations (Scopus)

Anion exchange membranes by bromination of tetramethylbiphenol-based poly(sulfone)s

Yan, J., Zhu, L., Chaloux, B. L. & Hickner, M. A., Apr 28 2017, In : Polymer Chemistry. 8, 16, p. 2442-2449 8 p.

Research output: Contribution to journalArticle

Sulfones
Halogenation
Bromosuccinimide
Anions
Ion exchange
29 Citations (Scopus)

An Ionophore-Based Anion-Selective Optode Printed on Cellulose Paper

Wang, X., Zhang, Q., Nam, C., Hickner, M., Mahoney, M. & Meyerhoff, M. E., Jan 1 2017, In : Angewandte Chemie - International Edition. 56, 39, p. 11826-11830 5 p.

Research output: Contribution to journalArticle

Ionophores
Cellulose
Anions
Negative ions
Fluorides
16 Citations (Scopus)

Annealed Ag contacts to MoS2 field-effect transistors

Abraham, M. & Mohney, S. E., Sep 21 2017, In : Journal of Applied Physics. 122, 11, 115306.

Research output: Contribution to journalArticle

contact resistance
field effect transistors
annealing
silver
19 Citations (Scopus)

A pathway to microstructural refinement through double pulsed gas metal arc welding

Wang, L. L., Wei, H. L., Xue, J. X. & DebRoy, T., Jun 1 2017, In : Scripta Materialia. 134, p. 61-65 5 p.

Research output: Contribution to journalArticle

arc welding
Gas metal arc welding
Cooling
Welding
Welds
6 Citations (Scopus)

A physical model of thermal vacancies within the CALPHAD approach

Guan, P. W. & Liu, Z. K., May 1 2017, In : Scripta Materialia. 133, p. 5-8 4 p.

Research output: Contribution to journalArticle

Vacancies
Bearings (structural)
Tungsten
Sublimation
Vapor pressure

A silicon microwire under a three-dimensional anisotropic tensile stress

Ji, X., Poilvert, N., Liu, W., Xiong, Y., Cheng, H. Y., Badding, J. V., Dabo, I. & Gopalan, V., Feb 27 2017, In : Applied Physics Letters. 110, 9, 091911.

Research output: Contribution to journalArticle

tensile stress
silicon
triaxial stresses
laser heating
silica glass
9 Citations (Scopus)

A theoretical study on the electronic and photophysical properties of two series of iridium(III) complexes with different substituted N^N ligand

Shang, X., Han, D., Liu, M. & Zhang, G., Jan 1 2017, In : RSC Advances. 7, 9, p. 5055-5062 8 p.

Research output: Contribution to journalArticle

Open Access
Iridium
Pyridine
Ligands
Density functional theory
Energy gap
5 Citations (Scopus)

A Thermodynamic Approach to Guide Reactive Element Doping: Hf Additions to NiCrAl

Gheno, T., Zhou, B. C., Ross, A., Liu, X., Lindwall, G., Liu, Z. K. & Gleeson, B., Apr 1 2017, In : Oxidation of Metals. 87, 3-4, p. 297-310 14 p.

Research output: Contribution to journalArticle

Chemical elements
Doping (additives)
Thermodynamics
Solubility
Metals
2 Citations (Scopus)

A thermodynamic description of metastable C-TiAlZrN coatings with triple spinodally decomposed domains

Zhou, J., Zhang, L., Chen, L., Du, Y. & Liu, Z. K., Jan 1 2017, In : Journal of Mining and Metallurgy, Section B: Metallurgy. 53, 2, p. 85-93 9 p.

Research output: Contribution to journalArticle

coating
thermodynamics
Thermodynamics
Coatings
diagram
7 Citations (Scopus)

A thermodynamic potential and the temperature-composition phase diagram for single-crystalline K1-xNaxNbO3 (0 ≤ x ≤ 0.5)

Pohlmann, H., Wang, J. J., Wang, B. & Chen, L. Q., Mar 6 2017, In : Applied Physics Letters. 110, 10, 102906.

Research output: Contribution to journalArticle

phase diagrams
thermodynamics
niobates
temperature
permittivity
3 Citations (Scopus)

A third-generation charge optimized many body (COMB3) potential for nitrogen-containing organic molecules

Martinez, J., Liang, T., Sinnott, S. B. & Phillpot, S. R., Nov 2017, In : Computational Materials Science. 139, p. 153-161 9 p.

Research output: Contribution to journalArticle

Nitrogen
Charge
Molecules
nitrogen
Binary System
4 Citations (Scopus)

A TiAlCu Metallization for ‘n’ Type CoSb x Skutterudites with Improved Performance for High-Temperature Energy Harvesting Applications

Rao, A., Bosak, G., Joshi, B., Keane, J., Nally, L., Peng, A., Perera, S., Waring, A. & Poudel, B., Apr 1 2017, In : Journal of Electronic Materials. 46, 4, p. 2419-2431 13 p.

Research output: Contribution to journalArticle

Skutterudites
metallizing
Energy harvesting
Metallizing
Thermoelectric power
41 Citations (Scopus)

Atomate: A high-level interface to generate, execute, and analyze computational materials science workflows

Mathew, K., Montoya, J. H., Faghaninia, A., Dwarakanath, S., Aykol, M., Tang, H., Chu, I. H., Smidt, T., Bocklund, B., Horton, M., Dagdelen, J., Wood, B., Liu, Z. K., Neaton, J., Ong, S. P., Persson, K. & Jain, A., Nov 2017, In : Computational Materials Science. 139, p. 140-152 13 p.

Research output: Contribution to journalArticle

Materials Science
Materials science
materials science
Work Flow
Python
20 Citations (Scopus)

Atomic and electronic basis for the serrations of refractory high-entropy alloys

Wang, W. Y., Shang, S. L., Wang, Y., Han, F., Darling, K. A., Wu, Y., Xie, X., Senkov, O. N., Li, J., Hui, X. D., Dahmen, K. A., Liaw, P. K., Kecskes, L. J. & Liu, Z. K., Dec 1 2017, In : npj Computational Materials. 3, 1, 24.

Research output: Contribution to journalArticle

Refractory materials
Entropy
Electronics
Metallic Glasses
Metallic glass
19 Citations (Scopus)

Atomic-resolution imaging of electrically induced oxygen vacancy migration and phase transformation in SrCoO2.5-σ

Zhang, Q., He, X., Shi, J., Lu, N., Li, H., Yu, Q., Zhang, Z., Chen, L. Q., Morris, B., Xu, Q., Yu, P., Gu, L., Jin, K. & Nan, C. W., Dec 1 2017, In : Nature communications. 8, 1, 104.

Research output: Contribution to journalArticle

Oxygen vacancies
phase transformations
Phase transitions
Oxygen
Imaging techniques
2 Citations (Scopus)

Biocompatible and Flexible Hydrogel Diode-Based Mechanical Energy Harvesting

Zhou, Y., Hou, Y., Li, Q., Yang, L., Cao, Y., Choi, K. H., Wang, Q. & Zhang, Q., Jan 1 2017, In : Advanced Materials Technologies. 2, 9, 1700118.

Research output: Contribution to journalArticle

Energy harvesting
Hydrogel
Hydrogels
Diodes
Electricity
7 Citations (Scopus)

Bio-modification of carbonaceous matter in gold ores: Model experiments using powdered activated carbon and cell-free spent medium of Phanerochaete chrysosporium

Konadu, K. T., Sasaki, K., Kaneta, T., Ofori-Sarpong, G. & Osseo-Asare, K. A., Mar 1 2017, In : Hydrometallurgy. 168, p. 76-83 8 p.

Research output: Contribution to journalArticle

Gold
Activated carbon
Ores
Carbon
manganese peroxidase
11 Citations (Scopus)

Broad-Range Electrically Tunable Plasmonic Resonances of a Multilayer Coaxial Nanohole Array with an Electroactive Polymer Wrapper

Zhou, Z., Yu, Y., Sun, N., Möhwald, H., Gu, P., Wang, L., Zhang, W., König, T. A. F., Fery, A. & Zhang, G., Oct 11 2017, In : ACS Applied Materials and Interfaces. 9, 40, p. 35244-35252 9 p.

Research output: Contribution to journalArticle

Polymers
Multilayers
Surface plasmon resonance
Nanocomposites
Electrodes
40 Citations (Scopus)

Building blocks for a digital twin of additive manufacturing

Knapp, G. L., Mukherjee, T., Zuback, J. S., Wei, H. L., Palmer, T. A., De, A. & DebRoy, T., Aug 15 2017, In : Acta Materialia. 135, p. 390-399 10 p.

Research output: Contribution to journalArticle

3D printers
Dendrites (metallography)
Solidification
Deposits
Cooling
26 Citations (Scopus)

Building digital twins of 3D printing machines

DebRoy, T., Zhang, W., Turner, J. & Babu, S. S., Jul 1 2017, In : Scripta Materialia. 135, p. 119-124 6 p.

Research output: Contribution to journalArticle

printing
Printing
Acoustic waves
Mechanical properties
Microstructure
2 Citations (Scopus)

Carbonate Dynamics and Opportunities with Low Temperature, Anion Exchange Membrane-Based Electrochemical Carbon Dioxide Separators

Rigdon, W. A., Omasta, T. J., Lewis, C., Hickner, M. A., Varcoe, J. R., Renner, J. N., Ayers, K. E. & Mustain, W. E., May 1 2017, In : Journal of Electrochemical Energy Conversion and Storage. 14, 2, 020901.

Research output: Contribution to journalArticle

Carbonates
Separators
Carbon Dioxide
Anions
Ion exchange
44 Citations (Scopus)

Cationic Side-Chain Attachment to Poly(Phenylene Oxide) Backbones for Chemically Stable and Conductive Anion Exchange Membranes

Pan, J., Han, J., Zhu, L. & Hickner, M. A., Jun 27 2017, In : Chemistry of Materials. 29, 12, p. 5321-5330 10 p.

Research output: Contribution to journalArticle

Polyphenylene oxides
Oxides
Anions
Ion exchange
Negative ions
12 Citations (Scopus)
specular reflection
infrared reflection
silica glass
calcium oxides
Fused silica
17 Citations (Scopus)

Characterization of the strength of support structures used in powder bed fusion additive manufacturing of Ti-6Al-4V

Bobbio, L. D., Qin, S., Dunbar, A., Michaleris, P. & Beese, A. M., Mar 1 2017, In : Additive Manufacturing. 14, p. 60-68 9 p.

Research output: Contribution to journalArticle

3D printers
Powders
Fusion reactions
Ligaments
Stress concentration
4 Citations (Scopus)

Charge optimized many body (COMB) potentials for Pt and Au

Antony, A. C., Akhade, S. A., Lu, Z., Liang, T., Janik, M. J., Phillpot, S. R. & Sinnott, S. B., Apr 28 2017, In : Journal of Physics Condensed Matter. 29, 22, 225901.

Research output: Contribution to journalArticle

Surface diffusion
Energy barriers
Stacking faults
Elastic constants
Parameterization
20 Citations (Scopus)

Cold sintering and co-firing of a multilayer device with thermoelectric materials

Funahashi, S., Guo, H., Guo, J., Baker, A. L., Wang, K., Shiratsuyu, K. & Randall, C. A., Aug 2017, In : Journal of the American Ceramic Society. 100, 8, p. 3488-3496 9 p.

Research output: Contribution to journalArticle

ceramics
Multilayers
Sintering
Polymers
Interdiffusion (solids)
14 Citations (Scopus)

Cold sintering of a Li-ion cathode: LiFePO4-composite with high volumetric capacity

Seo, J. H., Guo, J., Guo, H., Verlinde, K., Heidary, D. S. B., Rajagopalan, R. & Randall, C. A., Dec 1 2017, In : Ceramics International. 43, 17, p. 15370-15374 5 p.

Research output: Contribution to journalArticle

Cathodes
Sintering
Ions
Composite materials
Ceramic materials
50 Citations (Scopus)

Cold sintering process: A new era for ceramic packaging and microwave device development

Guo, J., Baker, A. L., Guo, H., Lanagan, M. & Randall, C. A., Feb 1 2017, In : Journal of the American Ceramic Society. 100, 2, p. 669-677 9 p.

Research output: Contribution to journalArticle

Microwave devices
Packaging
Sintering
Microwaves
Dielectric properties
20 Citations (Scopus)

Cold sintering process for 8 mol%Y2O3-stabilized ZrO2 ceramics

Guo, H., Bayer, T. J. M., Guo, J., Baker, A. & Randall, C. A., May 1 2017, In : Journal of the European Ceramic Society. 37, 5, p. 2303-2308 6 p.

Research output: Contribution to journalArticle

Sintering
Vickers hardness
Densification
Fracture toughness
Compaction
31 Citations (Scopus)

Cold sintering process for ZrO2-based ceramics: significantly enhanced densification evolution in yttria-doped ZrO2

Guo, H., Guo, J., Baker, A. & Randall, C. A., Feb 1 2017, In : Journal of the American Ceramic Society. 100, 2, p. 491-495 5 p.

Research output: Contribution to journalArticle

Yttrium oxide
Densification
Sintering
Zirconia
Vickers hardness
33 Citations (Scopus)

Cold sintering process of Li1.5Al0.5Ge1.5(PO4)3 solid electrolyte

Berbano, S. S., Guo, J., Guo, H., Lanagan, M. T. & Randall, C. A., May 1 2017, In : Journal of the American Ceramic Society. 100, 5, p. 2123-2135 13 p.

Research output: Contribution to journalArticle

Solid electrolytes
electrolyte
Sintering
ceramics
Electrolytes