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Yuuichi Orimoto

Showing results (1-10 of 29) with videos related to

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The Journal of Physical Chemistry. A|August 2, 2007
Strong electron correlation effects on first- and second-order hyperpolarizabilities in zwitterionic sigma-conjugated systems: its dependence on substituents, conformations, spacer size, and basis setsYuuichi Orimoto, Yuriko Aoki
Journal of Chemical Theory and Computation|December 3, 2015
Analytical Method for Predicting Ferromagnetic Properties of Benzyl-Radical Polymers Based on NBMO TheoryYuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics|July 17, 2016
Automated property optimization via ab initio O(N) elongation method: Application to (hyper-)polarizability in DNAYuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry|August 10, 2019
Extent of structural change during the reaction and its relationship to isoselectivity in polypropylene polymerization with ansa-zirconocene/borate catalyst: A computational studyYuuichi Orimoto, Satoru Shirane, Yuriko Aoki
Journal of Chemical Theory and Computation|November 24, 2015
Substituent Effects on Menshutkin-Type Reactions in the Gas Phase and Solutions: Theoretical Approach from the Orbital Interaction ViewLizhi Jiang, Yuuichi Orimoto, Yuriko Aoki
Molecules (Basel, Switzerland)|May 7, 2025
Mechanistic Study of Substituent Effect on Photoinduced O-C Bond Activation in PolycarbonateXiao Huang, Yuuichi Orimoto, Yuriko Aoki
Molecules (Basel, Switzerland)|June 13, 2025
Application of Elongation Method-Based Alternating Property Optimization: (Hyper)polarizability of Substituted PolyfuranShichen Lin, Yuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics|June 1, 2022
Local electronic structure analysis by ab initio elongation method: A benchmark using DNA block polymersYuuichi Orimoto, Keisuke Hisama, Yuriko Aoki
Molecules (Basel, Switzerland)|September 13, 2025
Theoretical Examination on the Chiral Separation Mechanism of Ibuprofen on Cellulose Tris(4-methylbenzoate)Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry|February 8, 2025
Elongation Method-Based Alternating Multi-Directional Automated Property Optimization Process and Its ApplicationShichen Lin, Yuuichi Orimoto, Yuriko Aoki
Pageof 3

Showing results (1-10 of 29) with videos related to

Sort By:
Pageof 3
The Journal of Physical Chemistry. A|August 2, 2007
Strong electron correlation effects on first- and second-order hyperpolarizabilities in zwitterionic sigma-conjugated systems: its dependence on substituents, conformations, spacer size, and basis setsYuuichi Orimoto, Yuriko Aoki
Journal of Chemical Theory and Computation|December 3, 2015
Analytical Method for Predicting Ferromagnetic Properties of Benzyl-Radical Polymers Based on NBMO TheoryYuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics|July 17, 2016
Automated property optimization via ab initio O(N) elongation method: Application to (hyper-)polarizability in DNAYuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry|August 10, 2019
Extent of structural change during the reaction and its relationship to isoselectivity in polypropylene polymerization with ansa-zirconocene/borate catalyst: A computational studyYuuichi Orimoto, Satoru Shirane, Yuriko Aoki
Journal of Chemical Theory and Computation|November 24, 2015
Substituent Effects on Menshutkin-Type Reactions in the Gas Phase and Solutions: Theoretical Approach from the Orbital Interaction ViewLizhi Jiang, Yuuichi Orimoto, Yuriko Aoki
Molecules (Basel, Switzerland)|May 7, 2025
Mechanistic Study of Substituent Effect on Photoinduced O-C Bond Activation in PolycarbonateXiao Huang, Yuuichi Orimoto, Yuriko Aoki
Molecules (Basel, Switzerland)|June 13, 2025
Application of Elongation Method-Based Alternating Property Optimization: (Hyper)polarizability of Substituted PolyfuranShichen Lin, Yuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics|June 1, 2022
Local electronic structure analysis by ab initio elongation method: A benchmark using DNA block polymersYuuichi Orimoto, Keisuke Hisama, Yuriko Aoki
Molecules (Basel, Switzerland)|September 13, 2025
Theoretical Examination on the Chiral Separation Mechanism of Ibuprofen on Cellulose Tris(4-methylbenzoate)Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry|February 8, 2025
Elongation Method-Based Alternating Multi-Directional Automated Property Optimization Process and Its ApplicationShichen Lin, Yuuichi Orimoto, Yuriko Aoki
Pageof 3