Tada T. (Ed.) Quantum Chemistry - Molecules for Innovations

InTech, 2012. — 200 p. — ISBN: 9535103721 9789535103721.This book is devoted for the theoretical foundations and innovative applications in quantum chemistry - an important theory for the understanding of molecular properties such as stability, reactivity, and applicability for devices.Theories in Quantum Chemistry
Numerical Solution of Linear Ordinary Differential Equations in Quantum Chemistry by Spectral Method
Composite Method Employing Pseudopotential at CCSD(T) LevelElectronic Structures and Molecular Properties
Quantum Chemical Calculations for some Isatin Thiosemicarbazones
Elementary Molecular Mechanisms of the Spontaneous Point Mutations in DNA: A Novel Quantum-Chemical Insight into the Classical Understanding
Quantum Chemistry and Che mo metrics Applied to Conformational AnalysisMolecules to Nanodevices
Quantum Transport and Quantum Information Processing in Single Molecular Junctions
Charge Carrier Mobility in Phthalocyanines: Experiment and Quantum Chemical Calculations
Theoretical Study for High Energy Density Compounds from Cvclophosphazene