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Solvation Effects on Chemical Shifts by Embedded Cluster Integral Equation Theory
British Library Online Contents | 2014| -
Experimental and Computational Study of CO~2 Storage and Sequestration with Aqueous 2-Amino-2-hydroxymethyl-1,3-propanediol (TRIS) Solutions
British Library Online Contents | 2014| -
Extended Y-Rule Method for the Characterization of the Aromatic Sextets in Cata-Condensed Polycyclic Aromatic Hydrocarbons
British Library Online Contents | 2014| -
Vibrations of Bioionic Liquids by Ab Initio Molecular Dynamics and Vibrational Spectroscopy
British Library Online Contents | 2014| -
Photoreactivity of a Quantum Dot-Ruthenium Nitrosyl Conjugate
British Library Online Contents | 2014| -
Energy Disposal and Thermal Rate Constants for the OH + HBr and OH + DBr Reactions: Quasiclassical Trajectory Calculations on an Accurate Potential Energy Surface
British Library Online Contents | 2014| -
What We Can Learn from the Norms of One-Particle Density Matrices, and What We Can't: Some Results for Interstate Properties in Model Singlet Fission Systems
British Library Online Contents | 2014| -
Can Short- and Middle-Range Hybrids Describe the Hyperpolarizabilities of Long-Range Charge-Transfer Compounds?
British Library Online Contents | 2014| -
Ring-Puckering Effects on Electron Momentum Distributions of Valence Orbitals of Oxetane
British Library Online Contents | 2014| -
Photophysics of Organometallic Platinum(II) Derivatives of the Diketopyrrolopyrrole Chromophore
British Library Online Contents | 2014| -
Ion-Specific Solvation Water Dynamics: Single Water versus Collective Water Effects
British Library Online Contents | 2014| -
The Interaction of Propionic and Butyric Acids with Ice and HNO~3-Doped Ice Surfaces at 195-212 K
British Library Online Contents | 2014| -
Radical-Triplet Pair Mechanism of Electron Spin Polarization, Detailed Theoretical Treatment
British Library Online Contents | 2014| -
Monitoring the Birth of an Electronic Wavepacket in a Molecule with Attosecond Time-Resolved Photoelectron Spectroscopy
British Library Online Contents | 2014| -
Room Temperature Hole-Burning of X-ray Induced Sm^2^+ in Nanocrystalline Ba~0~.~5Sr~0~.~5FCl~0~.~5Br~0~.~5:Sm^3^+ Prepared by Mechanochemistry
British Library Online Contents | 2014| -
X-ray Spectroscopic Study of Solvent Effects on the Ferrous and Ferric Hexacyanide Anions
British Library Online Contents | 2014| -
Hydroxyl Migration in Heterotrimetallic Clusters: An Assessment of Fluxionality Pathways
British Library Online Contents | 2014| -
Theoretical Study of the Hydrogen Abstraction of Substituted Phenols by Nitrogen Dioxide as a Source of HONO
British Library Online Contents | 2014| -
Interpretation of X-ray Absorption Spectra of As(III) in Solution Using Monte Carlo Simulations
British Library Online Contents | 2014|
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