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Reactivity of HCO with CH3 and NH2 on Water Ice Surfaces. A Comprehensive Accurate Quantum Chemistry Study

机译：HCO与CH3和NH2在水冰表面上的反应性。全面准确的量子化学研究

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Joan Enrique-Romero; Albert Rimola; Cecilia Ceccarelli; Piero Ugliengo; Nadia Balucani; Dimitrios Skouteris;
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年度 2019
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1. Raman scattering studies of pressure-induced phase transitions in perovskite formates [(CH3)(2)NH2][Mg(HCOO)(3)] and [(CH3)(2)NH2][Cd(HCOO)(3)] [J] . Maczka M., Almeida da Silva T., Paraguassu W., Spectrochimica acta, Part A. Molecular and biomolecular spectroscopy . 2016,第Null期

机译：钙钛矿形式[（CH3）（2）NH2] [Mg（HCOO）（3）]和[（CH3）（2）NH2] [Cd（HCOO）（3）]的压力诱导相变的拉曼散射研究
2. ONIOM(QM:AMOEBA09) Study on Binding Energies and Binding Preference of OH, HCO, and CH3 Radicals on Hexagonal Water Ice (I-h) [J] . Sameera W. M. C., Senevirathne Bethmini, Andersson Stefan, The journal of physical chemistry, C. Nanomaterials and interfaces . 2017,第28期

机译：ONIOM（QM：AmoEBA09）六边形水冰上的烯，HCO和CH3基团的结合能和结合偏好的研究（I-H）
3. On the gas-phase formation of the HCO- anion: accurate quantum study of the H- + CO radiative association and HCO radiative electron attachment [J] . Stoecklin Thierry, Halvick Philippe, Lara-Moreno Miguel, Faraday discussions . 2018,第期

机译：关于HCO-阴离子的气相形成：H-+ CO辐射关联和HCO辐射电子附件的精确量子研究
4. A Combined DFT and RRKM-Based Study on the Reactivity of HCO + NH_2 on Amorphous Water Ice Surface [C] . Joan Enrique-Romero, Albert Rimola, Cecilia Ceccarelli International Conference Computational Science and Its Applications . 2020

机译：基于DFT和RRKM基于RRKM的基于HCO + NH_2对非晶水冰表面的反应性研究
5. Quantum chemical studies of the reactivity of chemisorbed carbon monoxide bond and carbon hydrogen(x) on transition metal surfaces. [D] . de Koster, Adrianus. 1989

机译：过渡金属表面化学吸附的一氧化碳键和碳氢（x）反应性的量子化学研究。
6. A comparison between quantum chemistry and quantum Monte Carlo techniques for the adsorption of water on the (001) LiH surface [O] . Theodoros Tsatsoulis, Felix Hummel, Denis Usvyat, -1

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7. Reactivity of HCO with CH3 and NH2 on Water Ice Surfaces. A Comprehensive Accurate Quantum Chemistry Study [O] . -1

机译：HCO与CH3和NH2在水冰表面上的反应性。全面准确的量子化学研究

Reactivity of HCO with CH3 and NH2 on Water Ice Surfaces. A Comprehensive Accurate Quantum Chemistry Study

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