Quantum Chemistry Molecules for Innovations by Tomofumi Tada
File Type :Online Number of Pages :212
Description This
book is devoted for the theoretical foundations and innovative
applications in quantum chemistry. Topics covered includes: Numerical
Solution of Linear Ordinary Differential Equations in Quantum Chemistry
by Spectral Method, Composite Method Employing Pseudopotential at CCSD(T)
Level, Quantum Chemical Calculations for some Isatin Thiosemicarbazones,
Elementary Molecular Mechanisms of the Spontaneous Point Mutations in
DNA, Quantum Chemistry and Chemometrics Applied to Conformational
Analysis, Charge Carrier Mobility in Phthalocyanines, Theoretical Study
for High Energy Density Compounds from Cyclophosphazene.
