Zobrazeno 1 - 10
of 13
pro vyhledávání: '"Masoumeh Molaei"'
Publikováno v:
IETE Journal of Research. :1-8
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b4aad86657a6b77d431437d77a8281e4
https://doi.org/10.1080/03772063.2022.2027283
https://doi.org/10.1080/03772063.2022.2027283
Autor:
Masoumeh, Molaei, Saeid, Alipour, Ehsan, Targholi, Razieh, Farahati, S Morteza, Mousavi-Khoshdel
Publikováno v:
Journal of molecular modeling. 27(6)
This study aimed to investigate the H
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::758580352acb524b782fd3be81a2953e
https://pubmed.ncbi.nlm.nih.gov/34031733
https://pubmed.ncbi.nlm.nih.gov/34031733
Publikováno v:
Computational Materials Science. 139:347-353
The current study aimed to investigate the tetracyanobenzene (TCNB) anchored on graphene as a possible organic electrode material for Na-ion batteries using density functional theory method. According to the obtained results, TCNB containing four cya
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a9895e78805a590dd7bdf670ebad6418
https://doi.org/10.1016/j.commatsci.2017.08.023
https://doi.org/10.1016/j.commatsci.2017.08.023
Publikováno v:
Current Applied Physics. 17:272-278
The current article carried out density functional theory calculations to investigate the 2, 5-furandicarbonitrile (FUDCN) capability for storing Na atoms. The results indicated that this organic molecule could adsorb two sodium atoms with 454 mAh g
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::86df69929c9be88d71411fde754a7feb
https://doi.org/10.1016/j.cap.2016.12.005
https://doi.org/10.1016/j.cap.2016.12.005
Publikováno v:
Journal of Molecular Modeling. 25
The suitability of P-doped g-C3N4 for sodium storage was assessed using density functional theory. The electronic structure of P-doped g-C3N4 was calculated and the results indicate that the presence of the P atom causes the band gap of g-C3N4 to nar
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::811697820e3f4dfbe6c14d17d3aad5dd
https://doi.org/10.1007/s00894-019-4109-1
https://doi.org/10.1007/s00894-019-4109-1
Publikováno v:
Chemical Physics Letters. 775:138614
In this work, we investigated the ORR process on the surface of graphitic carbon nitride (g-C3N4), S-, O-, and P-doped g-C3N4 by the DFT method. According to the results, the reaction begins with Li adsorption and the first adsorbed Li atom is probab
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f90df6eb332f8d25a8a238a306c65541
https://doi.org/10.1016/j.cplett.2021.138614
https://doi.org/10.1016/j.cplett.2021.138614
Publikováno v:
Chemical Physics Letters. 664:96-100
The effects of atomic oxygen chemisorption on the electronic structures and quantum capacitance of (10, 10) CNT have been studied in this article. The results indicated that the chemisorption on bonds aligned with nanotube axis is more favorable than
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::3d33dc755a3ba513cab60b5c6c3c5ce4
https://doi.org/10.1016/j.cplett.2016.10.018
https://doi.org/10.1016/j.cplett.2016.10.018
Publikováno v:
Journal of molecular modeling. 25(8)
The suitability of P-doped g-C
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::721e540f70d90bb21d9fd12b7a0531ff
https://pubmed.ncbi.nlm.nih.gov/31375928
https://pubmed.ncbi.nlm.nih.gov/31375928
Publikováno v:
Arabian Journal of Geosciences. 10
Neotrocholina Reichel, 1956 is one of the most important benthic foraminifera in Early Cretaceous. Some of the species of this genus are indexes in biostratigraphy especially for this interval (e.g., Neotrocholina friburgensis: Late Barremian–Early
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::753abd509b01e3c2e5f829ad507cfa01
https://doi.org/10.1007/s12517-017-3073-2
https://doi.org/10.1007/s12517-017-3073-2
Publikováno v:
Renewable and Sustainable Energy Reviews. 15:4934-4938
In this work, biomass-derived energy has been highlighted and biomass has been divided into three main categories: agricultural residues, animal waste, and municipal solid waste. Energy is essential for the economic and social development and improve
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1c879d28bb87867cf8a219800a89fbfe
https://doi.org/10.1016/j.rser.2011.07.060
https://doi.org/10.1016/j.rser.2011.07.060