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Иш: Theoretical insights into the application of petal Graphyne monolayer as a promising sensor for propylene oxide

Multiwfn: A multifunctional wavefunction analyzer
Tian Lu, Feiwu Chen
Мақола2011110 иқтибос
ABI
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
Chengteh Lee, Weitao Yang, Robert G. Parr
Мақола198884 иқтибос
ABI
Electric Field Effect in Atomically Thin Carbon Films
Kostya S. Novoselov, A. K. Geǐm, С. В. Морозов +5
Мақола200466 иқтибос
ABI
The electronic properties of graphene
A. H. Castro Neto, F. Guinea, N. M. R. Peres +2
Мақола200939 иқтибос
ABI
Self-consistent molecular orbital methods. XX. A basis set for correlated wave functions
R. Krishnan, J. Stephen Binkley, Rolf Seeger +1
Мақола198029 иқтибос
ABI
The rise of graphene
A. K. Geǐm, Kostya S. Novoselov
Мақола200728 иқтибос
ABI
Effect of the damping function in dispersion corrected density functional theory
Stefan Grimme, Stephan Ehrlich, Lars Goerigk
Мақола201125 иқтибос
ABI
Graphene: Status and Prospects
A. K. Geǐm
Мақола200915 иқтибос
ABI
Revealing Noncovalent Interactions
Erin R. Johnson, Shahar Keinan, Paula Mori‐Sánchez +3
Мақола20109 иқтибос
ABI
Biphenylene network: A nonbenzenoid carbon allotrope
Qitang Fan, Linghao Yan, Matthias W. Tripp +8
Мақола20219 иқтибос
ABI
Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint
Alan E. Reed, Larry A. Curtiss, Frank Weinhold
Шарҳ мақола19888 иқтибос
ABI
Irida-graphene as a high-performance anode for sodium batteries
Nicolas F. Martins, José A.S. Laranjeira, Guilherme S. L. Fabris +2
Мақола20246 иқтибос
ABI
Graphene/Polymer Nanocomposites
Hyunwoo Kim, Ahmed Abdala, Christopher W. Macosko
Мақола20105 иқтибос
ABI
Electronic Properties of the Biphenylene Sheet and Its One-Dimensional Derivatives
Mathew A. Hudspeth, Brandon Whitman, Verónica Barone +1
Мақола20105 иқтибос
ABI
Silicon Carbide Based Nanotubes as a Sensing Material for Gaseous H2SiCl2
Mohsen Doust Mohammadi, Hewa Y. Abdullah, Somnath Bhowmick +1
Мақола20224 иқтибос
ABI
The electronic structure, transport and structural properties of nitrogen-decorated graphdiyne nanomaterials
İskender Muz, Mustafa Kurban
Мақола20204 иқтибос
ABI
Graphene in the Aquatic Environment: Adsorption, Dispersion, Toxicity and Transformation
Jian Zhao, Zhenyu Wang, Jason C. White +1
Шарҳ мақола20144 иқтибос
ABI
Adsorption of air pollutants onto silver and gold atomic clusters: DFT and PNO-LCCSD-F12 calculations
Mohsen Doust Mohammadi, Nikolaos Patsalidis, Somnath Bhowmick +2
Мақола20234 иқтибос
ABI
Graphene Quantum Dots
Mitchell Bacon, Siobhan J. Bradley, Thomas Nann
Мақола20133 иқтибос
ABI
Biphenylene and Phagraphene as Lithium Ion Battery Anode Materials
D. Ferguson, Debra J. Searles, Marlies Hankel
Мақола20173 иқтибос
ABI
Theoretical characterization of tolanene: A new 2D sp-sp2 hybridized carbon allotrope
Saif Ullah, Marcos G. Menezes, Alexander Silva
Мақола20233 иқтибос
ABI
Penta-graphene: A new carbon allotrope
Shunhong Zhang, Jian Zhou, Qian Wang +3
Мақола20153 иқтибос
ABI
The adsorption of bromomethane onto the exterior surface of aluminum nitride, boron nitride, carbon, and silicon carbide nanotubes: A PBC-DFT, NBO, and QTAIM study
Mohsen Doust Mohammadi, Majid Hamzehloo
Мақола20182 иқтибос
ABI
Origin of Strong Excitation Wavelength Dependent Fluorescence of Graphene Oxide
Scott K. Cushing, Ming Li, Feng Xu +1
Мақола20132 иқтибос
ABI
Graphene fiber: a new trend in carbon fibers
Zhen Xu, Chao Gao
Мақола20152 иқтибос
ABI