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机译:两种质子转移配合物的电荷密度分析:了解氢键和晶体内偶极矩的确定
Chemistry and Physics of Materials Unit Jawaharlal Nehru Center for Advanced Scientific Research Jakkur P.O. Bangalore 560 064 India;
Chemistry and Physics of Materials Unit Jawaharlal Nehru Center for Advanced Scientific Research Jakkur P.O. Bangalore 560 064 India;
Theoretical Sciences Unit Jawaharlal Nehru Center for Advanced Scientific Research Jakkur P.O. Bangalore 560 064 India;
Institute of Low Temperatures and Structure Research Polish Akademy of Sciences ul Okolna 2 50422 Wroclaw Poland;
Faculty of Chemistry University of Wroclaw 50-383 Wroclaw Poland;
Theoretical Sciences Unit Jawaharlal Nehru Center for Advanced Scientific Research Jakkur P.O. Bangalore 560 064 India;
Chemistry and Physics of Materials Unit Jawaharlal Nehru Center for Advanced Scientific Research Jakkur P.O. Bangalore 560 064 India;
X-ray diffraction; experimental charge density; hydrogen bonding; dipole moment; ab-initio calculations;
机译:两种质子转移配合物的电荷密度分析:了解氢键和晶体内偶极矩的确定
机译:探索激发态的氢键导致分子内质子转移:使用QTAIM沿反应路径详细分析结构和电荷密度拓扑
机译:对电荷转移跃迁中偶极矩变化的定量理解:跃迁金属配合物的电吸收光谱
机译:细胞色素C氧化酶对质子转移途径入口处的质子化环境对质子化状态的影响
机译:激发态化学的研究:第1部分。吡啶基吡咯醇复合物中的氢键和激发态质子转移的潜力。第2部分。单重态氧化学发光检测方法的开发和应用。
机译:可变碱度的非血红素铁氧络合物激活X-H键(X = CNO)时的二分氢原子转移与质子耦合电子转移
机译:两种质子转移复合物的电荷密度分析:了解氢键和晶体偶极矩的测定