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Molecules (Basel, Switzerland)
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June 13, 2025
Application of Elongation Method-Based Alternating Property Optimization: (Hyper)polarizability of Substituted Polyfuran
Shichen Lin, Yuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics
|
September 4, 2007
Assessment of time-dependent density functional schemes for computing the oscillator strengths of benzene, phenol, aniline, and fluorobenzene
Masanori Miura, Yuriko Aoki, Benoît Champagne
Journal of Molecular Modeling
|
April 17, 2015
Interaction of OH- with xylan and its hydrated complexes: structures and molecular dynamics study using elongation method
Lin Jin, Kai Liu, Yuriko Aoki
Materials (Basel, Switzerland)
|
August 16, 2017
An Efficient Local Molecular Dynamics Polymerization Simulation Combined with an <i>Ab Initio</i> MO Method
Peng Xie, Yuuichi Orimoto, Yuriko Aoki
The Journal of Physical Chemistry. A
|
July 28, 2021
Theoretical Analysis of Properties of Ground and Excited States for Photodissociation of the C-O Bond in Polycarbonates
Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
The Journal of Physical Chemistry. A
|
October 3, 2024
Photodegradation Pathways of Aliphatic Polyamide through Conical Intersection between Ground and Excited States
Jingcheng Sang, Yuuichi Orimoto, Yuriko Aoki
Physical Chemistry Chemical Physics : PCCP
|
December 11, 2023
Theoretical design of durable and strong polycarbonates against photodegradation
Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
Journal of Chemical Theory and Computation
|
July 20, 2023
Fast and Accurate Calculation of the UV-Vis Spectrum with the Modified Local Excitation Approximation
Denis Mashkovtsev, Yuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry
|
September 5, 2015
Elongation method for electronic structure calculations of random DNA sequences
Yuuichi Orimoto, Kai Liu, Yuriko Aoki
ACS Central Science
|
July 6, 2018
One-Handed Helical Orbitals in Conjugated Molecules
Yuriko Aoki, Yuuichi Orimoto, Akira Imamura
Page
of 7
Search research articles
Search
Showing results (11-20 of 61) with videos related to
Sort By:
Page
of 7
Molecules (Basel, Switzerland)
|
June 13, 2025
Application of Elongation Method-Based Alternating Property Optimization: (Hyper)polarizability of Substituted Polyfuran
Shichen Lin, Yuuichi Orimoto, Yuriko Aoki
The Journal of Chemical Physics
|
September 4, 2007
Assessment of time-dependent density functional schemes for computing the oscillator strengths of benzene, phenol, aniline, and fluorobenzene
Masanori Miura, Yuriko Aoki, Benoît Champagne
Journal of Molecular Modeling
|
April 17, 2015
Interaction of OH- with xylan and its hydrated complexes: structures and molecular dynamics study using elongation method
Lin Jin, Kai Liu, Yuriko Aoki
Materials (Basel, Switzerland)
|
August 16, 2017
An Efficient Local Molecular Dynamics Polymerization Simulation Combined with an <i>Ab Initio</i> MO Method
Peng Xie, Yuuichi Orimoto, Yuriko Aoki
The Journal of Physical Chemistry. A
|
July 28, 2021
Theoretical Analysis of Properties of Ground and Excited States for Photodissociation of the C-O Bond in Polycarbonates
Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
The Journal of Physical Chemistry. A
|
October 3, 2024
Photodegradation Pathways of Aliphatic Polyamide through Conical Intersection between Ground and Excited States
Jingcheng Sang, Yuuichi Orimoto, Yuriko Aoki
Physical Chemistry Chemical Physics : PCCP
|
December 11, 2023
Theoretical design of durable and strong polycarbonates against photodegradation
Xiao Huang, Yuuichi Orimoto, Yuriko Aoki
Journal of Chemical Theory and Computation
|
July 20, 2023
Fast and Accurate Calculation of the UV-Vis Spectrum with the Modified Local Excitation Approximation
Denis Mashkovtsev, Yuuichi Orimoto, Yuriko Aoki
Journal of Computational Chemistry
|
September 5, 2015
Elongation method for electronic structure calculations of random DNA sequences
Yuuichi Orimoto, Kai Liu, Yuriko Aoki
ACS Central Science
|
July 6, 2018
One-Handed Helical Orbitals in Conjugated Molecules
Yuriko Aoki, Yuuichi Orimoto, Akira Imamura
Page
of 7