Protontransfer相关论文
The excited-state intramolecular proton transfer of 2-(2\'-hydroxyphenyl)benzoxazole dye in different solvents is in-v......
不论在自然光合作用系统中,还是在人工能量转换系统如电解水制氢、二氧化碳还原、电化学固氮和金属空气电池中,析氧反应(OER)均是......
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Owing to its reversible H2 oxidation reaction,hydrogenase(H2ase)is one of the most highly studied enzymes,with promising......
Understanding the structure,structural dynamics and energy flow dynamics of hydrogen bond and proton transfer process is......
Multiple-State Nonadiabatic Dynamics Simulation of Photoisomerization of Acetylacetone with the Dire
In the present work,the quantum trajectory mean-field(QTMF)approach is numerically implemented by ab initio calculation ......
The Transition from the Single Protonation to the Double Protonation:Theoretical Studies on the Clus
Atmospheric nucleation is the dominant source of aerosol particles in the global atmosphere and an important player in a......
Our research is focused on in-depth study of bioinspired proton transfer processes in catalysis that lead to discovery o......
Proton transfer is of great importance in chemical and biological systems.Here we proposed a new method for promoting th......
Cα-Cβ Bond Cleavage Occurs at the Side Chain of the N-Terminal Phenylalanine Residue During CID of T
Molecular radical cationic peptides(M·+)display rich and diverse gas-phase ion chemistry that can differ substantia......
The interaction between 2-(2-Amino-3-Pyridyl)benzimidazole (2A3PyBI) and Cucurbit[6]uril (CB6) have been investigate......
Water as dual functional cocatalyst： A theoretical study on the mechanism of direct aldol reaction o
在包含氨基酸衍生物在水上催化的 3-pentanone 和 4-nitrobenzaldehyde 的直接 syn 丁间醇醛反应的水和 stereoselectivity 的角色......
Phosphazene base,t-BuP2,was employed to catalyze the proton transfer polymerization (PTP) of 2-hydroxyethyl acrylate (HE......
针对水体中痕量VOCs快速在线检测技术缺乏,提出一种喷雾进样-质子转移反应质谱(Spray inlet proton transfer reaction mass s......
The transportation of the proton, the smallest ion in nature, is rudimentary in chemical and biological reactions [1,2],......
