Mekhola Sinha
Current Organizations / Institutes
The organizations/institutes from the scholar's latest article
Research Subjects
Mekhola Sinha has a total of 24 co-authors. Here are the top co-authors by number of shared publications:
- Tyrel M. McQueen
The Johns Hopkins University
4 shared publications Hector K. Vivanco
Department of Chemistry, The Johns Hopkins University, Baltimore, Maryland 21218, United States
3 shared publications- Lucas A. Pressley
Oak Ridge National Laboratory
2 shared publications - Tanya Berry
Johns Hopkins University
2 shared publications - William Adam Phelan
Los Alamos National Laboratory
2 shared publications - Allyson Marie Fry-Petit
Department of Chemistry and Biochemistry, California State University Fullerton, Fullerton, CA 92831, USA
1 shared publication
Latest Publications
- 3 August 2022
- Published by American Chemical Society (ACS) in Crystal Growth & Design
- Vol. 22 (9) , 5629-5638
Optimization of PbTiO3 Single Crystals with Flux and Laser Floating Zone Method
- 3 August 2022
- Published by American Chemical Society (ACS) in Crystal Growth & Design
- Vol. 22 (9) , 5629-5638
Optimization of PbTiO3 Single Crystals with Flux and Laser Floating Zone Method
- 10 February 2022
- Published by American Chemical Society (ACS) in Inorganic Chemistry
- Vol. 61 (7) , 3007-3017
The Role of Phonons and Oxygen Vacancies in Non-Cubic SrVO3
Combining neutron diffraction with pair distribution function analysis, we have uncovered hidden reduced symmetry in the correlated metallic d1 perovskite, SrVO3. Specifically, we show that both the local and global structures are better described using a GdFeO3 distorted (orthorhombic) model as opposed to the ideal cubic ABO3 perovskite type. Recent reports of imaginary phonon frequencies in the density functional theory (DFT)-calculated phonon dispersion for cubic SrVO3 suggest a possible origin of this observed non-cubicity. Namely, the imaginary frequencies computed could indicate that the cubic crystal structure is unstable at T = 0 K. However, our DFT calculations provide compelling evidence that point defects in the form of oxygen vacancies, and not an observable symmetry breaking associated with calculated imaginary frequencies, primarily result in the observed non-cubicity of SrVO3. These experimental and computational results are broadly impactful because they reach into the thin-film and theoretical communities who have shown that SrVO3 is a technologically viable transparent conducting oxide material and have used SrVO3 to develop theoretical methods, respectively.
- 10 February 2022
- Published by American Chemical Society (ACS) in Inorganic Chemistry
- Vol. 61 (7) , 3007-3017
The Role of Phonons and Oxygen Vacancies in Non-Cubic SrVO3
Combining neutron diffraction with pair distribution function analysis, we have uncovered hidden reduced symmetry in the correlated metallic d1 perovskite, SrVO3. Specifically, we show that both the local and global structures are better described using a GdFeO3 distorted (orthorhombic) model as opposed to the ideal cubic ABO3 perovskite type. Recent reports of imaginary phonon frequencies in the density functional theory (DFT)-calculated phonon dispersion for cubic SrVO3 suggest a possible origin of this observed non-cubicity. Namely, the imaginary frequencies computed could indicate that the cubic crystal structure is unstable at T = 0 K. However, our DFT calculations provide compelling evidence that point defects in the form of oxygen vacancies, and not an observable symmetry breaking associated with calculated imaginary frequencies, primarily result in the observed non-cubicity of SrVO3. These experimental and computational results are broadly impactful because they reach into the thin-film and theoretical communities who have shown that SrVO3 is a technologically viable transparent conducting oxide material and have used SrVO3 to develop theoretical methods, respectively.
- Open Access
- 6 August 2021
- Published by American Chemical Society (ACS) in ACS Central Science
- Vol. 7 (8) , 1381-1390
Twisting of 2D Kagomé Sheets in Layered Intermetallics
- 6 August 2021
- Published by American Chemical Society (ACS) in ACS Central Science
- Vol. 7 (8) , 1381-1390
Open AccessTwisting of 2D Kagomé Sheets in Layered Intermetallics
- 18 December 2019
- Published by American Physical Society (APS) in Physical Review Materials
- Vol. 3 (12) , 125002
Introduction of spin centers in single crystals ofDeveloping the field of quantum information science (QIS) hinges upon designing viable qubits, the smallest unit in quantum computing. One approach to creating qubits is introducing paramagnetic defects into semiconductors or insulators. This class of qubits has seen success in the form of nitrogen-vacancy centers in diamond, divacancy defects in SiC, and P doped into Si. These materials feature paramagnetic defects in a low-nuclear-spin environment to reduce the impact of nuclear spin on electronic spin coherence. In this work, we report single-crystal growth of and the coherence properties of introduced spin centers generated by oxygen vacancies. () is a B-site ordered double perovskite with a temperature-dependent octahedral tilting wherein oxygen vacancies generate (), , , centers. We characterized these defects by measuring the spin-lattice () and spin-spin relaxation () times from . At , and , establishing the viability of these qubit candidates. With increasing temperature, remains constant up to and then decreases to at , and remains roughly constant until , demonstrating the remarkable stability of with increasing temperature. Together, these results demonstrate that systematic defect generation in double-perovskite structures can generate viable paramagnetic point centers for quantum applications and expand the field of potential materials for QIS.- 18 December 2019
- Published by American Physical Society (APS) in Physical Review Materials
- Vol. 3 (12) , 125002
Introduction of spin centers in single crystals ofDeveloping the field of quantum information science (QIS) hinges upon designing viable qubits, the smallest unit in quantum computing. One approach to creating qubits is introducing paramagnetic defects into semiconductors or insulators. This class of qubits has seen success in the form of nitrogen-vacancy centers in diamond, divacancy defects in SiC, and P doped into Si. These materials feature paramagnetic defects in a low-nuclear-spin environment to reduce the impact of nuclear spin on electronic spin coherence. In this work, we report single-crystal growth of and the coherence properties of introduced spin centers generated by oxygen vacancies. () is a B-site ordered double perovskite with a temperature-dependent octahedral tilting wherein oxygen vacancies generate (), , , centers. We characterized these defects by measuring the spin-lattice () and spin-spin relaxation () times from . At , and , establishing the viability of these qubit candidates. With increasing temperature, remains constant up to and then decreases to at , and remains roughly constant until , demonstrating the remarkable stability of with increasing temperature. Together, these results demonstrate that systematic defect generation in double-perovskite structures can generate viable paramagnetic point centers for quantum applications and expand the field of potential materials for QIS.