Работы, на которые ссылается эта работа

Работ: 56

Работа: Development of efficient both work function and electric type sensor for the detection of nitrous oxide toxic gas via TM metal boron nitride graphdiyne nanosheets: A DFT study

General atomic and molecular electronic structure system
Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz +10
Статья1993Цитирований: 49
ABI
cclib: A library for package‐independent computational chemistry algorithms
Noel M. O’Boyle, Adam L. Tenderholt, Karol M. Langner
Статья2007Цитирований: 27
ABI
The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors
Samuel Francis Boys, Fernando Bernardi
Статья1970Цитирований: 25
ABI
Detection of phosgene by Sc-doped BN nanotubes: A DFT study
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Accurate description of van der Waals complexes by density functional theory including empirical corrections
Stefan Grimme
Статья2004Цитирований: 9
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Electrophilicity Index
Robert G. Parr, László von Szentpály, Shubin Liu
Статья1999Цитирований: 9
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Pd-doped MoS2 monolayer: A promising candidate for DGA in transformer oil based on DFT method
Hao Cui, Xiaoxing Zhang, Guozhi Zhang +1
Статья2018Цитирований: 7
ABI
Molecular structure, vibrational spectral assignments, MEP, HOMO-LUMO, AIM, NCI, RDG, ELF, LOL properties of acetophenone and for its solutions based on DFT calculations
А. Jumabaev, Bekzod Khudaykulov, Utkirjon Holikulov +6
СтатьяNonlinear Optical Materials ResearchOptical Materials2025Цитирований: 6
ABI
Adsorption of melphalan anticancer drug on C24, B12N12, B12C6N6, B6C12N12 and B6C6N12 nanocages: A comparative DFT study
Christian A. Celaya, Luis Felipe Hernández‐Ayala, Fernando Buendía +2
Статья2021Цитирований: 6
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Carbon Nanotube Sensors for Gas and Organic Vapor Detection
Jing Li, Yijiang Lu, Ye Qi +3
Статья2003Цитирований: 6
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Recent advances on graphene: Synthesis, properties and applications
Feizhi Zhang, Kang Yang, Guanjun Liu +4
Статья2022Цитирований: 5
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Study on novel fluorescent carbon nanomaterials in food analysis
Ngafwan NGAFWAN, Harun Al Rasyid, Emad Salaam Abood +4
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Theoretical study of dibenzotetraaza[14]annulene complexes with first row transition metals
Natanael de Sousa Sousa, Roberto Batista de Lima, Adilson Luís Pereira Silva +3
Статья2014Цитирований: 4
ABI
Theoretical Study on the Al-Doped ZnO Nanoclusters for CO Chemical Sensors
Nasser L. Hadipour, Ali Ahmadi Peyghan, Hamed Soleymanabadi
Статья2015Цитирований: 4
ABI
DFT and QTAIM investigations of the adsorption of chlormethine anticancer drug on the exterior surface of pristine and transition metal functionalized boron nitride fullerene
Md. Rakib Hossain, Md. Mehade Hasan, Maliha Nishat +4
Статья2020Цитирований: 3
ABI
The role of NaOH and papaya latex bio-activator during production of carbon nanoparticle from rice husks
N Ngafwan, I.N.G. Wardana, Widya Wijayanti +1
Статья2018Цитирований: 3
ABI
Types of Nanostructures
Mahmoud Nasrollahzadeh, Zahra Issaabadi, Mohaddeseh Sajjadi +2
Глава2019Цитирований: 3
ABI
Detection of nitrobenzene using transition metal doped C24: A DFT study
Debolina Paul, Antara Vaidyanathan, Utpal Sarkar +1
Статья2021Цитирований: 3
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The Development Trend of Graphene Derivatives
Chen Li, Cun Zheng, Feng Cao +2
Статья2022Цитирований: 3
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Unveiling regularities of B12N12-X nanocages as a drug delivery vehicle for the nitrosourea: The influence of periods and groups
Y.B. Zhang, Yafei Luo, Lingkai Tang +2
Статья2023Цитирований: 3
ABI
Richardson-Dushman Equation Monograph
Arthur L. Smith, R. Breitwieser
Статья1970Цитирований: 2
ABI
Semiconductor Junction Gas Sensors
Karin Potje‐Kamloth
Обзорная статья2008Цитирований: 2
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DFT study on the functionalization of a BN nanotube with sulfamide
Javad Beheshtian, Ali Ahmadi Peyghan, Mohammad Bigdeli Tabar +1
Статья2012Цитирований: 2
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Chemical hardness and density functional theory
Ralph G. Pearson
Статья2005Цитирований: 2
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Ab initio study of CNT NO2 gas sensor
Shu Peng, Kyeongjae Cho, Pengfei Qi +1
Статья2004Цитирований: 2
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