Soft Chemical Routes to Heterostructured High-Tc Superconducting Materials

MRS Bulletin ◽  
2000 ◽  
Vol 25 (9) ◽  
pp. 32-39 ◽  
Author(s):  
Jin-Ho Choy ◽  
Soon-Jae Kwon ◽  
Seong-Ju Hwang ◽  
Eue-Soon Jang

Recently, inorganic/inorganic and organic/inorganic heterostructured materials have attracted considerable research interest, due to their unusual physicochemical properties, which cannot be achieved by conventional solid-state reactions. In order to develop new hybrid materials, various synthetic approaches, such as vacuum deposition, Langmuir–Blodgett films, selfassembly, and intercalation techniques, have been explored. Among them, the intercalation reaction technique—that is, the reversible insertion of guest species into the two-dimensional host lattice—is expected to be one of the most effective tools for preparing new layered heterostructures because this process can provide a soft chemical way of hybridizing inorganic/inorganic, organic/inorganic, or biological/inorganic compounds. In fact, the intercalation/deintercalation process allows us to design high-performance materials in a solution at ambient temperature and pressure, just as “soft solution processing” provides a simple and economical route for advanced inorganic materials by means of an environmentally benign, lowenergy method. These unique advantages of the intercalation technique have led to its wide application to diverse fields of the solid-state sciences, namely, secondary (rechargeable) batteries, electrochromic systems, oxidation–reduction catalysts, separating agents, sorbents, and so on. Through these extensive studies, many kinds of low-dimensional compounds have been developed as host materials for the intercalation reaction, including graphite, transition-metal chalcogenides, transitionmetal oxides, aluminosilicates, metal phosphates, metal chalcogenohalides, and so on. Recently, the area of intercalation chemistry has been extended to high-Tc superconducting copper oxides, resulting in remarkable structural anisotropy.

Small Science ◽  
2021 ◽  
pp. 2100012
Author(s):  
Yu Li ◽  
Feng Wu ◽  
Ji Qian ◽  
Minghao Zhang ◽  
Yanxian Yuan ◽  
...  

2020 ◽  
Author(s):  
Etienne Palos ◽  
Armando Reyes-Serrato ◽  
Gabriel Alonso-Nuñez ◽  
J. Guerrero Sánchez

In the ongoing pursuit of inorganic compounds suitable for solid-state devices, transition metal chalcogenides have received heightened attention due to their physical and chemical properties. Recently, alkali-ion transition metal chalcogenides have been explored as promising candidates to be applied in optoelectronics, photovoltaics and energy storage devices. In this work, we present a comprehensive theoretical study of sodium molybdenum selenide (Na<sub>2</sub>MoSe<sub>4</sub>). First-principles computations were performed on a set of hypothetical crystal structures to determine the ground state and electronic properties of Na<sub>2</sub>MoSe<sub>4</sub>. We find that the equilibrium structure of Na<sub>2</sub>MoSe<sub>4</sub> is a simple orthorhombic (<i>oP</i>) lattice, with space group Pnma, as evidenced by thermodynamics. Electronic structure computations reveal that three phases are semiconducting, while one (<i>cF</i>) is metallic. Relativistic effects and Coulomb interaction of localized electrons were assessed for the <i>oP</i> phase, and found to have a negligible influence on the band strucutre. Finally, meta-GGA computations were performed to model the band structure of primitive orthorhombic Na<sub>2</sub>MoSe<sub>4</sub> at a predictive level. We employ the Tran-Blaha modified Becke-Johnson potential to demonstrate that <i>oP</i> Na2MoSe4 is a semiconductor with a direct bandgap of 0.53 eV at the <b>Γ</b> point. Our results provide a foundation for future studies concerned with the modeling of inorganic and hybrid organic-inorganic materials chemically analogous to Na<sub>2</sub>MoSe<sub>4</sub>.<br>


2016 ◽  
Vol 18 (9) ◽  
pp. 2619-2624 ◽  
Author(s):  
Maryam Moradi ◽  
Jae Chul Kim ◽  
Jifa Qi ◽  
Kang Xu ◽  
Xin Li ◽  
...  

Bio-facilitated solid state solution: we investigate an energy-efficient synthesis that merges the bio-templated technique and solid-state reactions to produce a wide range of nano-structured complex inorganic materials.


2021 ◽  
Author(s):  
Muratahan Aykol ◽  
Joseph H. Montoya ◽  
Jens Strabo Hummelshøj

Rational solid-state synthesis of inorganic compounds is formulated as catalytic nucleation on crystalline reactants, where contributions of reaction and interfacial energies to the nucleation barriers are approximated from high-throughput thermochemical data, and structural and interfacial features of crystals, respectively. Favorable synthesis reactions are then identified by a Pareto analysis of relative nucleation barriers and phase-selectivities of reactions leading to the target. We demonstrate the application of this approach in reaction planning for solid-state synthesis of a range of compounds, including the widely-studied oxides LiCoO<sub>2</sub>, BaTiO<sub>3</sub> and YBa<sub>2</sub>Cu<sub>3</sub>O<sub>7</sub>, as well as other metal oxide, oxyfluoride, phosphate and nitride targets. Pathways for enabling retrosynthesis of inorganics are also discussed.


2020 ◽  
Author(s):  
Etienne Palos ◽  
Armando Reyes-Serrato ◽  
Gabriel Alonso-Nuñez ◽  
J. Guerrero Sánchez

In the ongoing pursuit of inorganic compounds suitable for solid-state devices, transition metal chalcogenides have received heightened attention due to their physical and chemical properties. Recently, alkali-ion transition metal chalcogenides have been explored as promising candidates to be applied in optoelectronics, photovoltaics and energy storage devices. In this work, we present a comprehensive theoretical study of sodium molybdenum selenide (Na<sub>2</sub>MoSe<sub>4</sub>). First-principles computations were performed on a set of hypothetical crystal structures to determine the ground state and electronic properties of Na<sub>2</sub>MoSe<sub>4</sub>. We find that the equilibrium structure of Na<sub>2</sub>MoSe<sub>4</sub> is a simple orthorhombic (<i>oP</i>) lattice, with space group Pnma, as evidenced by thermodynamics. Electronic structure computations reveal that three phases are semiconducting, while one (<i>cF</i>) is metallic. Relativistic effects and Coulomb interaction of localized electrons were assessed for the <i>oP</i> phase, and found to have a negligible influence on the band strucutre. Finally, meta-GGA computations were performed to model the band structure of primitive orthorhombic Na<sub>2</sub>MoSe<sub>4</sub> at a predictive level. We employ the Tran-Blaha modified Becke-Johnson potential to demonstrate that <i>oP</i> Na2MoSe4 is a semiconductor with a direct bandgap of 0.53 eV at the <b>Γ</b> point. Our results provide a foundation for future studies concerned with the modeling of inorganic and hybrid organic-inorganic materials chemically analogous to Na<sub>2</sub>MoSe<sub>4</sub>.<br>


Author(s):  
Koji Kosuge

As inorganic materials are put to more and more practical uses--mainly in electric, magnetic, and optical devices--materials scientists must have an increasingly sophisticated understanding of the chemical and physical properties of inorganic compounds. This volume--the first of its kind in twenty years--provides a unified presentation of the chemistry of non-stoichiometric compounds based on statistical thermodynamics and structural inorganic chemistry. Four modern examples of non-stoichiometric compounds--ionic conducting compounds, hydrogen absorbing alloys, magnetic materials, and electrical materials--are discussed in detail. Students and researchers in structural inorganic chemistry, crystallography, materials science, and solid state physics will find this much-needed book both practical and informative.


2014 ◽  
Vol 253 ◽  
pp. 360-365 ◽  
Author(s):  
Yaping Wang ◽  
Lili Zhang ◽  
Huanhuan Li ◽  
Yijing Wang ◽  
Lifang Jiao ◽  
...  

Small Science ◽  
2021 ◽  
Vol 1 (9) ◽  
pp. 2170022
Author(s):  
Yu Li ◽  
Feng Wu ◽  
Ji Qian ◽  
Minghao Zhang ◽  
Yanxian Yuan ◽  
...  

2020 ◽  
Author(s):  
Etienne Palos ◽  
Armando Reyes-Serrato ◽  
Gabriel Alonso-Nuñez ◽  
J. Guerrero Sánchez

In the ongoing pursuit of inorganic compounds suitable for solid-state devices, transition metal chalcogenides have received heightened attention due to their physical and chemical properties. Recently, alkali-ion transition metal chalcogenides have been explored as promising candidates to be applied in optoelectronics, photovoltaics and energy storage devices. In this work, we present a comprehensive theoretical study of sodium molybdenum selenide (Na<sub>2</sub>MoSe<sub>4</sub>). First-principles computations were performed on a set of hypothetical crystal structures to determine the ground state and electronic properties of Na<sub>2</sub>MoSe<sub>4</sub>. We find that the equilibrium structure of Na<sub>2</sub>MoSe<sub>4</sub> is a simple orthorhombic (<i>oP</i>) lattice, with space group Pnma, as evidenced by thermodynamics. Electronic structure computations reveal that three phases are semiconducting, while one (<i>cF</i>) is metallic. Relativistic effects and Coulomb interaction of localized electrons were assessed for the <i>oP</i> phase, and found to have a negligible influence on the band strucutre. Finally, meta-GGA computations were performed to model the band structure of primitive orthorhombic Na<sub>2</sub>MoSe<sub>4</sub> at a predictive level. We employ the Tran-Blaha modified Becke-Johnson potential to demonstrate that <i>oP</i> Na2MoSe4 is a semiconductor with a direct bandgap of 0.53 eV at the <b>Γ</b> point. Our results provide a foundation for future studies concerned with the modeling of inorganic and hybrid organic-inorganic materials chemically analogous to Na<sub>2</sub>MoSe<sub>4</sub>.<br>


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