• 已选条件：
  • × mdpi
  • × International Journal of Molecular Science
  • × DFT calculations
 全选  【符合条件的数据共：3条】

1 Towards Understanding the Decomposition/Isomerism Channels of Stratospheric Bromine Species: Ab Initio and Quantum Topology Study [期刊论文]

来源：International Journal of Molecular Sciences , 2015

作者:Saadullah G. Aziz;Abdulrahman O. Alyoubi;Shaaban A. Elroby;等

关键词:bromine bonds;quantum topology;...

使用许可:CC BY

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2 Theoretical and Experimental Spectroscopic Analysis of Cyano-Substituted Styrylpyridine Compounds [期刊论文]

来源：International Journal of Molecular Sciences , 2013

作者:Maria Eugenia Castro;Maria Judith Percino;Victor M. Chapela;等

关键词:styrylpyridine compounds;DFT calculations;...

使用许可:CC BY

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3 Reconciling Experiment and Theory in the Use of Aryl-Extended Calix[4]pyrrole Receptors for the Experimental Quantification of Chloride–π Interactions in Solution [期刊论文]

来源：International Journal of Molecular Sciences , 2015

作者:Antonio BauzáDavid Quiñonero;Antonio Frontera;等

关键词:anion–π interaction;DFT calculations;...

使用许可:CC BY

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