Electronic Structure and Chemical Bonding in the Double Ring Tubular Boron Clusters

2014 ◽  
Vol 118 (41) ◽  
pp. 24181-24187 ◽  
Author(s):  
Hung Tan Pham ◽  
Long Van Duong ◽  
Minh Tho Nguyen
Keyword(s):  
Electronic Structure ◽  
Chemical Bonding ◽  
Boron Clusters ◽  
Double Ring

Site-projected electronic structure of two-dimensional Ti3C2MXene: the role of the surface functionalization groups

2016 ◽  
Vol 18 (45) ◽  
pp. 30946-30953 ◽  
Author(s):  
Damien Magne ◽  
Vincent Mauchamp ◽  
Stéphane Célérier ◽  
Patrick Chartier ◽  
Thierry Cabioc'h
Keyword(s):  
Electronic Structure ◽  
Surface Functionalization ◽  
Chemical Bonding ◽  
Surface Groups ◽  
Two Dimensional ◽  
Object Level

The role of the surface groups in chemical bonding in two dimensional Ti3C2is evidenced at the nano-object level.

Anhydrous tin and lead hexacyanoferrates (II). Part II. Electronic structure and chemical bonding

2001 ◽  
Vol 3 (5) ◽  
pp. 539-544 ◽  
Author(s):  
Vladlen P. Zhukov ◽  
Veronika M. Zainullina ◽  
Vladimir G. Zubkov ◽  
Alexander P. Tyutyunnik ◽  
Tatiana A. Denisova
Keyword(s):  
Electronic Structure ◽  
Chemical Bonding

Electronic structure and chemical bonding in smart anti-corrosion coatings

2021 ◽  
pp. 102892
Author(s):  
Lyudmila Viktorovna Dobysheva ◽  
Feodor Feodorovich Chausov ◽  
Natalya Valentinovna Lomova
Keyword(s):  
Electronic Structure ◽  
Chemical Bonding

scholarly journals Chemical Bonding and the Sulfur K X-Ray Spectrum

1965 ◽  
Vol 9 ◽  
pp. 354-364 ◽  
Author(s):  
D. W. Wilbur ◽  
J. W. Gofman
Keyword(s):  
Electronic Structure ◽  
Single Crystal ◽  
Organic Compounds ◽  
Sulfur Atom ◽  
Chemical Bonding ◽  
Proportional Counter ◽  
Pulse Height ◽  
X Ray ◽  
Pulse Height Analysis ◽  
Chemical States

AbstractAn investigation has been made of the relative Kβ intensities in different chemical states of the sulfur atom using the Kα lines, with appropriate corrections, to provide the intensity standards. Both inorganic and organic compounds were included in the study. The data for each compound appear to be reliable to about ± 0.5%, while the whole series of compounds shows a variation greater than 20% in the corrected Kβ/Kα ratios. Energies were also measured, particularly the Kα energies, and their shifts were studied relative to the Kβ, intensity shifts. The work was done with a plane, single-crystal, helium-path spectrometer with proportional counter and pulse-height analysis for detection. The results are indicative of the usefulness of the method both in clarifying an uncertain chemical state and in studying the electronic structure of the bonded atom.

Relation between electronic structure and coordination number for boron clusters

1985 ◽  
Vol 20 (5) ◽  
pp. 565-567
Author(s):  
S. A. Prosandeev ◽  
Yu. B. Paderno ◽  
V. P. Sachenko
Keyword(s):  
Electronic Structure ◽  
Coordination Number ◽  
Boron Clusters

The Chemical Bonding of Organic-Inorganic in Hybrid Compounds

2004 ◽  
Vol 848 ◽  
Author(s):  
Yadong Dai ◽  
Liling Guo ◽  
Minjie Hu ◽  
Kunyu Shi ◽  
Xinmin Min ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Energy Density ◽  
Chemical Bonding ◽  
Fermi Energy ◽  
Energy Band Structure ◽  
Bond Orders ◽  
Density Of State ◽  
Hybrid Compound ◽  
Hybrid Compounds ◽  
Calculation Results

ABSTRACTAs has been discussed, research on the electronic structure between organic and inorganic atoms in hybrid compounds has become important. In our study, DV—Xα method was employed to calculate the electronic structure of the hybrid compound. The information obtained from the calculation included orbit charge, bonding order, Fermi energy, density of the state, etc. The influence of organic and inorganic parts on the energy band structure of the hybrid compound was discussed based on the calculation results of Fermi energy and density of state. The chemical bonding between organic and inorganic parts in the hybrid compound was also analyzed in detail according to the orbital charges and bond orders.

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