Zobrazeno 1 - 10
of 122
pro vyhledávání: '"Ghanshyam, Pilania"'
Autor:
Md Habibur Rahman, Prince Gollapalli, Panayotis Manganaris, Satyesh Kumar Yadav, Ghanshyam Pilania, Brian DeCost, Kamal Choudhary, Arun Mannodi-Kanakkithodi
Publikováno v:
APL Machine Learning, Vol 2, Iss 1, Pp 016122-016122-18 (2024)
First-principles computations reliably predict the energetics of point defects in semiconductors but are constrained by the expense of using large supercells and advanced levels of theory. Machine learning models trained on computational data, especi
Externí odkaz:
https://doaj.org/article/d69c2a05bee64b1d8b4edec5e91a559c
Publikováno v:
Communications Materials, Vol 4, Iss 1, Pp 1-14 (2023)
Abstract The compositional and structural variety inherent to oxide perovskites spawn wide-ranging applications. In perovskites, the band gap Eg, a key material parameter for these applications, can be optimally controlled by varying the composition.
Externí odkaz:
https://doaj.org/article/0321859fbf5c427d82b5f2c60874ec8f
Autor:
Christopher Kuenneth, Jessica Lalonde, Babetta L. Marrone, Carl N. Iverson, Rampi Ramprasad, Ghanshyam Pilania
Publikováno v:
Communications Materials, Vol 3, Iss 1, Pp 1-10 (2022)
Biodegradable polyhydroxyalkanoates are promising replacements for non-degradable plastics. Here, neural network property predictors are applied to a search space of approximately 1.4 million candidates, identifying 14 polyhydroxyalkanoates that coul
Externí odkaz:
https://doaj.org/article/3c9921783df34dd3ab1b366c1b850d84
Autor:
Binod Paudel, Yogesh Sharma, Benjamin K. Derby, Ghanshyam Pilania, Matthew M. Schneider, Andrew C. Jones, Heinz Nakotte, Michael T. Pettes, Aiping Chen
Publikováno v:
Materials Research Letters, Vol 10, Iss 1, Pp 29-35 (2022)
The influence of lattice strain on magnetism is studied for perovskite rare-earth chromite, YCrO3 (YCO) thin films. A combined theoretical and experimental approach is used to demonstrate the correlation between lattice-strain and magnetic properties
Externí odkaz:
https://doaj.org/article/8cdb1aa29ea241d785164ce5fb782064
Autor:
Jihyeon Kim, Nevin S. Gupta, Lindsey B. Bezek, Jacqueline Linn, Karteek K. Bejagam, Shounak Banerjee, Joseph H. Dumont, Sang Yong Nam, Hyun Woo Kang, Chi Hoon Park, Ghanshyam Pilania, Carl N. Iverson, Babetta L. Marrone, Kwan-Soo Lee
Publikováno v:
International Journal of Molecular Sciences, Vol 24, Iss 8, p 7638 (2023)
Due to increased environmental pressures, significant research has focused on finding suitable biodegradable plastics to replace ubiquitous petrochemical-derived polymers. Polyhydroxyalkanoates (PHAs) are a class of polymers that can be synthesized b
Externí odkaz:
https://doaj.org/article/f21ca7cfc2bc444abc17be305d9d83d1
Autor:
Karteek K. Bejagam, Nevin S. Gupta, Kwan-Soo Lee, Carl N. Iverson, Babetta L. Marrone, Ghanshyam Pilania
Publikováno v:
Polymers, Vol 14, Iss 2, p 345 (2022)
Polyhydroxyalkanoates (PHAs) have emerged as a promising class of biosynthesizable, biocompatible, and biodegradable polymers to replace petroleum-based plastics for addressing the global plastic pollution problem. Although PHAs offer a wide range of
Externí odkaz:
https://doaj.org/article/339429805a834ae6916220ab1a382a34
Autor:
Samuel D. Young, Bianca M. Ceballos, Amitava Banerjee, Rangachary Mukundan, Ghanshyam Pilania, Bryan R. Goldsmith
Publikováno v:
The Journal of Physical Chemistry C. 126:12980-12993
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::085ae2c92845599031becc8411af7217
https://doi.org/10.1021/acs.jpcc.2c02816
https://doi.org/10.1021/acs.jpcc.2c02816
Autor:
Amitava Banerjee, Bianca M. Ceballos, Cortney Kreller, Rangachary Mukundan, Ghanshyam Pilania
Publikováno v:
Journal of Materials Science. 57:10213-10224
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b0e6e34345ecc1c116350b0e0ba19ad0
https://doi.org/10.1007/s10853-022-07311-8
https://doi.org/10.1007/s10853-022-07311-8
Publikováno v:
APL Materials, Vol 7, Iss 10, Pp 100904-100904-9 (2019)
In the quest for enhanced functionality of all sorts, nanostructured materials are becoming ever more common. This is particularly true of oxide/oxide heterostructures in which the high density of interfaces has been implicated in enhanced properti
Externí odkaz:
https://doaj.org/article/81152a3e8e5b4e0081d093a4521e1f36
Perovskite oxynitrides (PONs) are a promising class of materials for applications ranging from catalysis to photovoltaics. However, the vast space of single PON materials (ABO3–xNx}) has yet to be fully explored. Additionally, the community needs g
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b35e3935d364c8149a9b9695bc3838f5
https://doi.org/10.26434/chemrxiv-2023-d2ccz
https://doi.org/10.26434/chemrxiv-2023-d2ccz
