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Time-dependent density functional theory study on hydrogen-bonded intramolecular charge-transfer excited state of 4-dimethylamino-benzonitrile in methanol
British Library Online Contents | 2008| -
A Nonuniformity Correction Algorithm for IRFPAs Based on Two Points and It's Realization by DSP
British Library Online Contents | 2007| -
Ultrafast Hydrogen Bond Strengthening of the Photoexcited Fluorenone in Alcohols for Facilitating the Fluorescence Quenching
British Library Online Contents | 2007| -
Early Time Hydrogen-Bonding Dynamics of Photoexcited Coumarin 102 in Hydrogen-Donating Solvents: Theoretical Study
British Library Online Contents | 2007| -
Comparison Between [Fe^I^V(O)(TMC)·(NCMe)]^2^+ and [Fe^I^V(O)(TMCS)]^+ Non-heme Complexes of Geometric, Electronic Structures, Bonding and Reactivities
British Library Online Contents | 2008| -
Understanding electron-withdrawing substituent effect on structural, electronic and charge transport properties of perylene bisimide derivatives
British Library Online Contents | 2011| -
Nonadiabatic Time-Dependent Wave Packet Study of the D^+ + H~2 Reaction System
British Library Online Contents | 2005| -
A Reactive Molecular Dynamics Study of n-Heptane Pyrolysis at High Temperature
British Library Online Contents | 2013| -
Non-Born-Oppenheimer dynamics calculations using the coherent switching with decay of mixing method
British Library Online Contents | 2010| -
Theoretical Studies of Benzonitrile at the Si(100)-2x1 Surface
British Library Online Contents | 2004| -
Hybrid functionals studies of structural and electronic properties of Zn"xCd"("1"-"x")S and (Zn"xCd"1"-"x)(Se"xS"1"-"x) solid solution photocatalysts
British Library Online Contents | 2012| -
First-Principles Investigation of the Electronic and Conducting Properties of Oligothienoacenes and their Derivatives
British Library Online Contents | 2012| -
Mo-S-I Nanowires: A Promising Anode Material for Lithium-Ion Batteries. A First-Principles Study
British Library Online Contents | 2009| -
Unveiling excited state energy transfer and charge transfer in a host/guest coordination cage
British Library Online Contents | 2018| -
Theoretical study of the stereodynamics of the reaction Cl+C3H8→C3H7+HCl
British Library Online Contents | 2005| -
A multi-gene estimate of phylogeny in the nightjars and nighthawks (Caprimulgidae)
British Library Online Contents | 2010| -
Revealing quantitative structure-activity relationships of transport properties in acene and acene derivative organic materials
British Library Online Contents | 2010|
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