Zobrazeno 1 - 10
of 17
pro vyhledávání: '"Jaye K. Harada"'
Autor:
P. Shiv Halasyamani, Christos D. Malliakas, Roberto dos Reis, Nenian Charles, Weiguo Zhang, Fenghua Ding, Matthew L. Nisbet, Vinayak P. Dravid, Jaye K. Harada, Kent J. Griffith, Chi Zhang, James M. Rondinelli, Kenneth R. Poeppelmeier
Publikováno v:
Journal of the American Chemical Society. 143:18907-18916
Elpasolite- and cryolite-type oxyfluorides can be regarded as superstructures of perovskite and exhibit structural diversity. While maintaining a similar structural topology with the prototype structures, changes in the size, electronegativity, and c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::cf2b616df88f6b619aba2960e9d1f208
https://doi.org/10.1021/jacs.1c05704
https://doi.org/10.1021/jacs.1c05704
Autor:
Roberto dos Reis, Kirsten M. Ø. Jensen, Kaustav Chatterjee, Jaye K. Harada, Vinayak P. Dravid, Jette K. Mathiesen, Sara E. Skrabalak, Sandra L. A. Bueno, James M. Rondinelli
Publikováno v:
Chemistry of Materials. 33:347-358
Metal heteroanionic compounds such as oxynitrides, oxysulfides, and oxyhalides have emerged as promising photocatalysts for water splitting, owing to their reduced band gaps compared to conventiona...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b4e3db191389c53ff059dc1a56bf076d
https://doi.org/10.1021/acs.chemmater.0c04037
https://doi.org/10.1021/acs.chemmater.0c04037
Autor:
Po-Hsiu Chien, Haoyu Liu, Chen Huang, James M. Rondinelli, Kenneth R. Poeppelmeier, Sawankumar Patel, Yan-Yan Hu, Jaye K. Harada
Publikováno v:
Chemistry of Materials. 32:5715-5722
The centrosymmetric polymorph of KNaNbOF5 undergoes a reconstructive transition from a rare A-site vacancy ordered perovskite to a unique nonperovskite high-temperature phase. Previously, the high ...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0f1936a45e99dac6628b1119cd770671
https://doi.org/10.1021/acs.chemmater.0c01439
https://doi.org/10.1021/acs.chemmater.0c01439
Publikováno v:
Chemistry of Materials. 32:2815-2823
A new ferroelectric perovskite oxynitride is proposed and demonstrated for photocatalytic applications using a systematic first-principles study. Ruddlesden–Popper (RP) Ca3Nb2N2O5, a layered struct...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::803d90da6e50f01440779bdaadcce3ce
https://doi.org/10.1021/acs.chemmater.9b04429
https://doi.org/10.1021/acs.chemmater.9b04429
Autor:
Po-Hsiu Chien, Yan-Yan Hu, Jaye K. Harada, Kenneth R. Poeppelmeier, Haoyu Liu, Sawankumar Patel, Nenian Charles, Ching-Hwa A. Chen, James M. Rondinelli
Publikováno v:
Physical Review Materials. 5
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9a2690fce91dfd264668687ea2c9449d
https://doi.org/10.1103/physrevmaterials.5.124401
https://doi.org/10.1103/physrevmaterials.5.124401
Autor:
Fenghua, Ding, Nenian, Charles, Jaye K, Harada, Christos D, Malliakas, Chi, Zhang, Roberto, Dos Reis, Kent J, Griffith, Matthew L, Nisbet, Weiguo, Zhang, P Shiv, Halasyamani, Vinayak P, Dravid, James M, Rondinelli, Kenneth R, Poeppelmeier
Publikováno v:
Journal of the American Chemical Society. 143(45)
Elpasolite- and cryolite-type oxyfluorides can be regarded as superstructures of perovskite and exhibit structural diversity. While maintaining a similar structural topology with the prototype structures, changes in the size, electronegativity, and c
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::96b6ac0272f4606d2399102d9b726d94
https://pubmed.ncbi.nlm.nih.gov/34729984
https://pubmed.ncbi.nlm.nih.gov/34729984
Publikováno v:
Physical Review Materials. 5
We describe a strategy to design ferroelectric heteroanionic materials based on the coupling of anion order and octahedral tilts in $n=1$ Ruddlesden-Popper structures, which allows noncentrosymmetric and polar compounds to arise from centrosymmetric
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::668f0ec872399783e44f848ac5f1ee94
https://doi.org/10.1103/physrevmaterials.5.104404
https://doi.org/10.1103/physrevmaterials.5.104404
Publikováno v:
Inorganic chemistry. 58(19)
We report a workflow for heteroanionic materials discovery using Pauling's second rule to filter for and predict new candidate materials for synthesis with reduced computational overhead. Using oxyfluoride and oxynitride n = 1 Ruddlesden-Popper compo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f3902b3ac3802cff7b404c2c1efaf6e5
https://pubmed.ncbi.nlm.nih.gov/31525967
https://pubmed.ncbi.nlm.nih.gov/31525967
Publikováno v:
Advanced materials (Deerfield Beach, Fla.). 31(19)
The burgeoning field of anion engineering in oxide-based compounds aims to tune physical properties by incorporating additional anions of different size, electronegativity, and charge. For example, oxychalcogenides, oxynitrides, oxypnictides, and oxy
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::60e66166cebde38951f8c48f0c06f7a8
https://pubmed.ncbi.nlm.nih.gov/30861235
https://pubmed.ncbi.nlm.nih.gov/30861235
Publikováno v:
Energy & Environmental Science. 8:1640-1650
In this work we present a data-driven approach to the rational design of battery materials based on both resource and performance considerations. A large database of Li-ion battery material has been created by abstracting information from over 200 pu
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::52bb6e57302ef5c05bf132585acb357a
https://doi.org/10.1039/c5ee00685f
https://doi.org/10.1039/c5ee00685f