Zobrazeno 1 - 9
of 9
pro vyhledávání: '"Shusil Bhusal"'
Publikováno v:
Carbon Trends, Vol 3, Iss , Pp 100039- (2021)
A systematic approach has been developed to generate and predict failure strengths of single-walled carbon nanotube (CNT) junctions with various sets of non-hexagonal defects (i.e., five-, seven-, eight-membered carbon rings). Each generated junction
Externí odkaz:
https://doaj.org/article/5913233db0c0473f964edea77fa414c9
Autor:
Changjun Oh, Youngjong Kang, Vikas Varshney, Yixin Ren, Gary S. Kedziora, Dhriti Nepal, Shusil Bhusal, Ajit K. Roy
Publikováno v:
The Journal of Physical Chemistry B. 125:2411-2424
Recently, thermoset vitrimer polymers have shown significant promise for structural applications because of their ability to be reshaped and remolded due to their covalent adaptive network (CAN). In these vitrimers, the transesterification reaction i
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d8105ad9821cf245b9df66a68818bbfe
https://doi.org/10.1021/acs.jpcb.0c10403
https://doi.org/10.1021/acs.jpcb.0c10403
Publikováno v:
American Society for Composites 2021.
Boron-carbon-nitride (BCN), a ternary system, enables us to compose a wide variety of novel materials due to their unique mechanical, thermal, and electrical properties. We study two-dimensional structures called nanoflakes made of boron, carbon, and
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d25f3238d83d969d0a14ee266ef8daa7
https://doi.org/10.12783/asc36/35864
https://doi.org/10.12783/asc36/35864
Publikováno v:
American Society for Composites 2020.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e84b546cb7dfaa3de0c099b0246329aa
https://doi.org/10.12783/asc35/34941
https://doi.org/10.12783/asc35/34941
Publikováno v:
The Journal of Physical Chemistry A. 121:3486-3493
We present a density functional study on the structural and electronic properties of ZnS bubble clusters, specifically, hollow cages whose spontaneous formation was previously observed in classical molecular dynamics simulations by Spano et al. [J. P
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::455fd7274ee6d71e8c3f7101df30b3c9
https://doi.org/10.1021/acs.jpca.6b12172
https://doi.org/10.1021/acs.jpca.6b12172
Publikováno v:
The Journal of Physical Chemistry C. 120:27813-27819
We report a detailed investigation of structural, electronic, and spectroscopic properties of VSc2N@C68 endohedral fullerene. First, the candidate structures of the ground state are obtained using a systematic approach in which 900 isomers of endohed
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c203df840db896287e0aaf5e8845ca78
https://doi.org/10.1021/acs.jpcc.6b08904
https://doi.org/10.1021/acs.jpcc.6b08904
Publikováno v:
American Society for Composites 2019.
Carbon nanotube (CNTs) junctions are not only the defect but also the required building blocks for many applications such as: switches, rectifiers, field effect transistors etc. The irregular nature of junctions invites defect sites (non-hexagonal ri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::43cc2b276b827c9798e94bebdc96d60d
https://doi.org/10.12783/asc34/31368
https://doi.org/10.12783/asc34/31368
Publikováno v:
International Journal of Quantum Chemistry. 118
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d6c6dddf3341a9f30e2ccbbe81049de7
https://doi.org/10.1002/qua.25785
https://doi.org/10.1002/qua.25785
Publikováno v:
The Journal of chemical physics. 143(8)
We investigate the polarizability of trimetallic nitride endohedral fullerenes by partitioning the total polarizability into site specific components. This analysis indicates that the polarizability of the endohedral fullerene is essentially due to t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7ebd4f6ba7af0f6f8ffa0b2d9e7fa1d0
https://pubmed.ncbi.nlm.nih.gov/26328842
https://pubmed.ncbi.nlm.nih.gov/26328842