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Quantitative Electrophilicity Measures

GONZÁLEZ Marco Martínez CÁRDENAS Carlos RODRÍGUEZ Juan I LIU Shubin HEIDAR-ZADEH Farnaz MIRANDA-QUINTANA Ramón Alain AYERS Paul W

物理化学学报2018，Vol.34Issue(6)：662-674,13.

物理化学学报2018，Vol.34Issue(6)：662-674,13.DOI:10.3866/PKU.WHXB201711021

Quantitative Electrophilicity Measures

GONZÁLEZ Marco Martínez ¹CÁRDENAS Carlos ²RODRÍGUEZ Juan I ³LIU Shubin ⁴HEIDAR-ZADEH Farnaz ⁵MIRANDA-QUINTANA Ramón Alain ⁶AYERS Paul W⁷

作者信息

1. Laboratory of Computational and Theoretical Chemistry, Faculty of Chemistry, University of Havana, Havana 10400, Cuba
2. Departamento de Química, and Centro de Química Universidade de Coimbra, 3004-535 Coimbra, Portuga
3. Departamento de Física, Facultad de Ciencias, Universidad de Chile, Casilla, 653 Santiago, Chile
4. Centro para el desarrollo de la Nanociencias y Nanotecnología, CEDENNA, Av. Ecuador 3493, Santiago, Chile
5. Escuela Superior de Física y Matemáticas, Instituto Politécnico Nacional, Edificio 9, U.P. A.L.M., Col. San Pedro Zacatenco, C.P. 07738, Ciudad de México, México
6. Research Computing Center, University of North Carolina, Chapel Hill, NC 27599-3420, USA
7. Department of Chemistry & Chemical Biology
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摘要

关键词

Electrophilicity/Conceptual density functional theory/Symbolic regression/Genetic programming/Grammatical evolution

Key words

Electrophilicity/Conceptual density functional theory/Symbolic regression/Genetic programming/Grammatical evolution

引用本文复制引用

GONZÁLEZ Marco Martínez,CÁRDENAS Carlos,RODRÍGUEZ Juan I,LIU Shubin,HEIDAR-ZADEH Farnaz,MIRANDA-QUINTANA Ramón Alain,AYERS Paul W..Quantitative Electrophilicity Measures[J].物理化学学报,2018,34(6):662-674,13.

基金项目

CC acknowledges support by FONDECYT (1140313), Financiamiento Basal para Centros Científicos y Tecnológicos de Excelencia-FB0807, and project RC-130006 CILIS （1140313）

Chile. PWA acknowledges support from NSERC, the Canada Research Chairs, and Compute Canada （）

Canada. （）

物理化学学报

OA北大核心CSCDCSTPCD

ISSN：1000-6818

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