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Journal of Computational Chemistry
|
March 20, 2014
Quantum-chemical analyses of aromaticity, UV spectra, and NMR chemical shifts in plumbacyclopentadienylidenes stabilized by Lewis bases
Toshiaki Kawamura, Minori Abe, Masaichi Saito, et al.
The Journal of Physical Chemistry. A
|
March 23, 2016
Heavy Element Effects in the Diagonal Born-Oppenheimer Correction within a Relativistic Spin-Free Hamiltonian
Yuji Imafuku, Minori Abe, Michael W Schmidt, et al.
The Journal of Chemical Physics
|
August 7, 2010
Ligand effect on uranium isotope fractionations caused by nuclear volume effects: An ab initio relativistic molecular orbital study
Minori Abe, Tatsuya Suzuki, Yasuhiko Fujii, et al.
The Journal of Chemical Physics
|
December 3, 2008
An ab initio molecular orbital study of the nuclear volume effects in uranium isotope fractionations
Minori Abe, Tatsuya Suzuki, Yasuhiko Fujii, et al.
Inorganic Chemistry
|
June 18, 2010
Unique properties and reactivity of high-valent manganese-oxo versus manganese-hydroxo in the salen platform
Takuya Kurahashi, Akihiro Kikuchi, Yoshitsugu Shiro, et al.
Inorganic Chemistry
|
October 22, 2019
<sup>13</sup>C and <sup>207</sup>Pb NMR Chemical Shifts of Dirhodio- and Dilithioplumbole Complexes: A Quantum Chemical Assessment
Radhika Narayanan, Marisa Nakada, Minori Abe, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 8, 2008
Evaluation of electron population terms for <r-3Se>4p, <r-3S>3p, and <r-3O>(2p): how do HOMO and LUMO shrink or expand depending on nuclear charges?
Waro Nakanishi, Satoko Hayashi, Kenji Narahara, et al.
Inorganic Chemistry
|
August 6, 2013
Oxygen-atom transfer from iodosylarene adducts of a manganese(IV) salen complex: effect of arenes and anions on I(III) of the coordinated iodosylarene
Chunlan Wang, Takuya Kurahashi, Kensuke Inomata, et al.
ACS Omega
|
January 18, 2021
Density Functional Study of Metal-to-Ligand Charge Transfer and Hole-Hopping in Ruthenium(II) Complexes with Alkyl-Substituted Bipyridine Ligands
Salmahaminati, Minori Abe, Indra Purnama, et al.
Journal of Computational Chemistry
|
April 3, 2019
Substitution effects on olefin epoxidation catalyzed by Oxoiron(IV) porphyrin π-cation radical complexes: A dft study
Zhifeng Ma, Kasumi Ukaji, Naoki Nakatani, et al.
Page
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Search research articles
Search
Showing results (41-50 of 66) with videos related to
Sort By:
Page
of 7
Journal of Computational Chemistry
|
March 20, 2014
Quantum-chemical analyses of aromaticity, UV spectra, and NMR chemical shifts in plumbacyclopentadienylidenes stabilized by Lewis bases
Toshiaki Kawamura, Minori Abe, Masaichi Saito, et al.
The Journal of Physical Chemistry. A
|
March 23, 2016
Heavy Element Effects in the Diagonal Born-Oppenheimer Correction within a Relativistic Spin-Free Hamiltonian
Yuji Imafuku, Minori Abe, Michael W Schmidt, et al.
The Journal of Chemical Physics
|
August 7, 2010
Ligand effect on uranium isotope fractionations caused by nuclear volume effects: An ab initio relativistic molecular orbital study
Minori Abe, Tatsuya Suzuki, Yasuhiko Fujii, et al.
The Journal of Chemical Physics
|
December 3, 2008
An ab initio molecular orbital study of the nuclear volume effects in uranium isotope fractionations
Minori Abe, Tatsuya Suzuki, Yasuhiko Fujii, et al.
Inorganic Chemistry
|
June 18, 2010
Unique properties and reactivity of high-valent manganese-oxo versus manganese-hydroxo in the salen platform
Takuya Kurahashi, Akihiro Kikuchi, Yoshitsugu Shiro, et al.
Inorganic Chemistry
|
October 22, 2019
<sup>13</sup>C and <sup>207</sup>Pb NMR Chemical Shifts of Dirhodio- and Dilithioplumbole Complexes: A Quantum Chemical Assessment
Radhika Narayanan, Marisa Nakada, Minori Abe, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 8, 2008
Evaluation of electron population terms for <r-3Se>4p, <r-3S>3p, and <r-3O>(2p): how do HOMO and LUMO shrink or expand depending on nuclear charges?
Waro Nakanishi, Satoko Hayashi, Kenji Narahara, et al.
Inorganic Chemistry
|
August 6, 2013
Oxygen-atom transfer from iodosylarene adducts of a manganese(IV) salen complex: effect of arenes and anions on I(III) of the coordinated iodosylarene
Chunlan Wang, Takuya Kurahashi, Kensuke Inomata, et al.
ACS Omega
|
January 18, 2021
Density Functional Study of Metal-to-Ligand Charge Transfer and Hole-Hopping in Ruthenium(II) Complexes with Alkyl-Substituted Bipyridine Ligands
Salmahaminati, Minori Abe, Indra Purnama, et al.
Journal of Computational Chemistry
|
April 3, 2019
Substitution effects on olefin epoxidation catalyzed by Oxoiron(IV) porphyrin π-cation radical complexes: A dft study
Zhifeng Ma, Kasumi Ukaji, Naoki Nakatani, et al.
Page
of 7