Correlation between Structure, Chemistry and Dielectric Properties of

2 days ago - X-ray diffraction (XRD) analyses confirmed that the sintered GFO compounds stabilized in monoclinic crystal structure with C2/m space gro...
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C: Plasmonics; Optical, Magnetic, and Hybrid Materials

Correlation between Structure, Chemistry and Dielectric Properties of Iron Doped Gallium Oxide (Ga FeO) 2-x

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Swadipta Roy, Mallesham Bandi, Vishal B Zade, Abraham Martinez, Vaithiyalingam Shutthanandan, Suntharampillai Thevuthasan, and Chintalapalle V Ramana J. Phys. Chem. C, Just Accepted Manuscript • DOI: 10.1021/acs.jpcc.8b07921 • Publication Date (Web): 22 Oct 2018 Downloaded from http://pubs.acs.org on October 22, 2018

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The Journal of Physical Chemistry

Correlation between Structure, Chemistry and Dielectric Properties of Iron Doped Gallium Oxide (Ga2-xFexO3) Swadipta Roy1,2, B. Mallesham1, Vishal B. Zade1, Abraham Martinez3, V. Shutthanandan3, S. Thevuthasan3, and C.V. Ramana1,* 1Center

for Advanced Materials Research (CMR), University of Texas at El Paso, 500 W University Ave, El Paso, Texas 79968, USA.

2Department

of Metallurgical, Materials and Biomedical Engineering,

University of Texas at El Paso, 500 W University Ave, El Paso, Texas 79968, USA. 3Environmental

Molecular Sciences Laboratory (EMSL), Pacific Northwest National Laboratory (PNNL), Richland, Washington 99352, USA.

*Corresponding Author: Email address: [email protected] (C. V. Ramana) 1 ACS Paragon Plus Environment

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ABSTRACT Iron (Fe) doped gallium oxide (Ga2O3) compounds (Ga2-xFexO3; x=0.0-0.3; referred to GFO) were synthesized by the standard high-temperature solid-state chemical reaction method. Xray diffraction (XRD) analyses confirmed that the sintered GFO compounds stabilized in monoclinic crystal structure with C2/m space group. Local structure and chemical bonding analyses using X-ray absorption near edge structure (XANES) revealed that the Fe occupies octahedral and tetrahedral sites similar to Ga in parent Ga2O3 lattice without considerable changes in the local symmetry. Morphology of the GFO compounds is characterized by the presence of rod-shaped particle (from around 2.0-3.5 μm) features. The energy dispersive X-ray spectroscopy (EDS) confirmed the chemical stoichiometry of the GFO compounds, where the atomic ratio of the constituted elements is in accordance with the calculated concentration values. The frequency and temperature dependent dielectric properties of the GFO compounds exhibited the traditional dielectric dispersion behavior. Relatively high dielectric constant at lower frequencies is attributed to Maxwell-Wagner type of dielectric relaxation which primarily originated from uncompensated charges at electrode material interface. Based on the results and analyses, the effect of Fe content on the crystal structure, chemical bonding and local structure, and dielectric properties of Ga2xFexO3 compounds

is established.

2 ACS Paragon Plus Environment

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The Journal of Physical Chemistry

I.

INTRODUCTION Wide band gap oxide dielectrics, such as ZrO2, HfO2, Ga2O3, and La2O3 and chemical

compounds based on these materials, are of continued recent interest due to their excellent electronic properties, optical phenomena and technological applications such as in microelectronics, low-loss dielectric nanoantenna, field effect transistor (FET), and complementary metal-oxide-semiconductor (CMOS).1–10 Ga2O3, one among these oxide dielectric materials, has been receiving significant attention in recent years due to its superior structural, chemical and electronic properties.1,2,4 Being a wide band gap (Eg∼4.9 eV) material, Ga2O3 finds numerous applications in optoelectronics, high power electronics, chemical sensing, dielectric coatings for solar cells and ultraviolet transparent conductive oxide (UV-TCO) in optical devices.3,11–13 The high breakdown field (8 MV/cm) of Ga2O3 offers excellent opportunities for the design and development of high power Schottky diodes and high-voltage field effect transistors.14 Gallium oxide exhibits five different polymorphs namely α, β, γ, δ, and ε.15 Among the different polymorphs of Ga2O3, β-Ga2O3 is thermodynamically more stable from ambient to until its melting point. Whereas other polymorphs α, γ, δ and ε are metastable and transforms into β phase at sufficiently high temperatures in air. The order of formation energies for different polymorphs is β < ε < α < δ