Predicting Trigger Bonds in Explosive Materials through Wiberg Bond Index Analysis

ChemPhysChem ◽  
2015 ◽  
Vol 16 (18) ◽  
pp. 3886-3892 ◽  
Author(s):  
Lenora K. Harper ◽  
Ashley L. Shoaf ◽  
Craig A. Bayse
Keyword(s):  
Bond Index ◽  
Explosive Materials ◽  
Index Analysis ◽  
Wiberg Bond Index

scholarly journals Theoretical Rationalization of Structure of Transannular Bonded Germanium Complexes Containing Amide Functionality

2020 ◽  
Vol 32 (5) ◽  
pp. 995-1000
Author(s):  
Raji Thomas ◽  
Pushpa Pardasani
Keyword(s):  
Electronic Properties ◽  
Electrostatic Potential ◽  
Molecular Electrostatic Potential ◽  
Natural Bond Orbital ◽  
Molecular Structures ◽  
Potential Analysis ◽  
Bond Index ◽  
Molar Ratios ◽  
Wiberg Bond Index

Penta and tetra coordinated germanium complexes have been synthesized from N,N’-bis(2-pyridyl)pyridine-2,6-dicarboxamide (H2L) and N-(pyridine-2-yl)picolinamide (HL1) with dialkyl/aryl and trialkyl/aryl germanium halides in 1:1 molar ratios. The molecular structures and electronic properties of complexes were well analyzed by GAUSSIAN 03 suit of programs. The transannular bonding observed in penta coordinated complexes have been well established by natural bond orbital, Wiberg bond index and molecular electrostatic potential analysis

Analisis Wilayah Kecamatan Potensial Melalui Pendekatan Tipologi Klassen di Kabupaten Ende

Analisis ◽  
2020 ◽  
Vol 19 (1) ◽  
pp. 39-49
Author(s):  
Estherlina Sagajoka
Keyword(s):  
Economic Development ◽  
Descriptive Analysis ◽  
Population Data ◽  
Spatial Inequality ◽  
Theil Index ◽  
Time Data ◽  
Entropy Index ◽  
Quantitative Descriptive Analysis ◽  
Index Analysis ◽  
The City

This study aims to determine the comparison of the results of the inequality analysis of economic development between districts / cities in the province of East Nusa Tenggara for the period of 2013-2018. The method used in this research is quantitative descriptive analysis using the Williamson index, and Theil Entropy Index, using time data per capita PDRB series and population data for each district / city in 2013-2018. The Williamson Index analysis results show that the economic development sector inequality in 21 districts in NTT province is very evenly distributed (low inequality) except for the city of Kupang, which has an Williamson Index value of 1.49 other than districts in NTT province in the period 2013-2018. The Intra Index Analysis Results show spatial inequality within the regency. The city of Nusa Tenggara Timur province is fairly evenly distributed within the regency except the city of Kupang  shows an unequal inequality compared to 21 other districts. Through the Theil Entropy Index calculation of development inequality between 21 regencies and Kupang  tend to widen (divergence) which has Theil  Index of 798,15, while the other 21 districts in the 2013-2018 period have the Theil Entropy Index Index 211,26 for Regencies and  TTS 201,11, while other districts have an index numberbelow 200.

Standoff Raman Detection of Explosive Materials Using a Small Raman Spectroscopy System

2017 ◽  
Vol 20 (3) ◽  
pp. 60-66 ◽  
Author(s):  
Naseer M. Hadi ◽  
◽  
Mohammad R. Mohammad ◽  
Haider G. Abdulzahraa ◽  
Keyword(s):  
Raman Spectroscopy ◽  
Explosive Materials ◽  
Spectroscopy System
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