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Journal of Chemical Theory and Computation
|
September 24, 2019
Photoabsorption Spectra of Aqueous Oxyluciferin Anions Elucidated by Explicit Quantum Solvent
Yoshifumi Noguchi, Miyabi Hiyama, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. B
|
August 2, 2016
Reverse Stability of Oxyluciferin Isomers in Aqueous Solutions
Yoshifumi Noguchi, Miyabi Hiyama, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. A
|
September 14, 2011
Quantum proton transfer in hydrated sulfuric acid clusters: a perspective from semiempirical path integral simulations
Shuichi Sugawara, Takehiro Yoshikawa, Toshiyuki Takayanagi, et al.
The Journal of Chemical Physics
|
May 27, 2009
On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy
Alexander Witt, Sergei D Ivanov, Motoyuki Shiga, et al.
Journal of Computational Chemistry
|
August 16, 2021
Mean force based temperature accelerated sliced sampling: Efficient reconstruction of high dimensional free energy landscapes
Asit Pal, Subhendu Pal, Shivani Verma, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 4, 2017
The effect of dynamical fluctuations of hydration structures on the absorption spectra of oxyluciferin anions in an aqueous solution
Miyabi Hiyama, Motoyuki Shiga, Nobuaki Koga, et al.
Physical Review Letters
|
May 28, 2024
High-Temperature Atomic Diffusion and Specific Heat in Quasicrystals
Yuki Nagai, Yutaka Iwasaki, Koichi Kitahara, et al.
Journal of Computational Chemistry
|
October 30, 2020
Refined metadynamics through canonical sampling using time-invariant bias potential: A study of polyalcohol dehydration in hot acidic solutions
Tomomi Kondo, Takehiko Sasaki, Sergi Ruiz-Barragan, et al.
Chemical Science
|
January 9, 2018
Dynamical effects on the magnetic properties of dithiazolyl bistable materials
Sergi Vela, Mercè Deumal, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. B
|
January 25, 2019
Understanding Competition of Polyalcohol Dehydration Reactions in Hot Water
Yong Lik Chang, Takehiko Sasaki, Jordi Ribas-Ariño, et al.
Page
of 6
Search research articles
Search
Showing results (41-50 of 52) with videos related to
Sort By:
Page
of 6
Journal of Chemical Theory and Computation
|
September 24, 2019
Photoabsorption Spectra of Aqueous Oxyluciferin Anions Elucidated by Explicit Quantum Solvent
Yoshifumi Noguchi, Miyabi Hiyama, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. B
|
August 2, 2016
Reverse Stability of Oxyluciferin Isomers in Aqueous Solutions
Yoshifumi Noguchi, Miyabi Hiyama, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. A
|
September 14, 2011
Quantum proton transfer in hydrated sulfuric acid clusters: a perspective from semiempirical path integral simulations
Shuichi Sugawara, Takehiro Yoshikawa, Toshiyuki Takayanagi, et al.
The Journal of Chemical Physics
|
May 27, 2009
On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy
Alexander Witt, Sergei D Ivanov, Motoyuki Shiga, et al.
Journal of Computational Chemistry
|
August 16, 2021
Mean force based temperature accelerated sliced sampling: Efficient reconstruction of high dimensional free energy landscapes
Asit Pal, Subhendu Pal, Shivani Verma, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 4, 2017
The effect of dynamical fluctuations of hydration structures on the absorption spectra of oxyluciferin anions in an aqueous solution
Miyabi Hiyama, Motoyuki Shiga, Nobuaki Koga, et al.
Physical Review Letters
|
May 28, 2024
High-Temperature Atomic Diffusion and Specific Heat in Quasicrystals
Yuki Nagai, Yutaka Iwasaki, Koichi Kitahara, et al.
Journal of Computational Chemistry
|
October 30, 2020
Refined metadynamics through canonical sampling using time-invariant bias potential: A study of polyalcohol dehydration in hot acidic solutions
Tomomi Kondo, Takehiko Sasaki, Sergi Ruiz-Barragan, et al.
Chemical Science
|
January 9, 2018
Dynamical effects on the magnetic properties of dithiazolyl bistable materials
Sergi Vela, Mercè Deumal, Motoyuki Shiga, et al.
The Journal of Physical Chemistry. B
|
January 25, 2019
Understanding Competition of Polyalcohol Dehydration Reactions in Hot Water
Yong Lik Chang, Takehiko Sasaki, Jordi Ribas-Ariño, et al.
Page
of 6