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Yasuhiro Ikabata

Waseda University

19H指数
92论文数
1.3K被引数
收录论文 19
发表时间
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Unveiling controlling factors of the S0/S1 minimum-energy conical intersection (3): Frozen orbital analysis based on the spin-flip theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-05-26
err2
PREAI
errYoshikawa, Takeshi; Ikabata, Yasuhiro; Nakai, Hiromi; Ogawa, Kentaro; Sakata, Ken
err分享
err收藏
Tetraaryldiborane(4) Can Emit Dual Fluorescence Responding to the Structural Change around the B-B Bond四芳基二硼烷 (4) 可以响应b-b键周围的结构变化而发出双重荧光
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2021-11-18
err8
PREAI
errShoji, Yoshiaki; Tanaka, Naoki; Ikabata, Yasuhiro; Sakai, Hayato; Hasobe, Taku; Koch, Norbert; Nakai, Hiromi; Fukushima, Takanori
err分享
err收藏
An Air- and Water-Stable B4N4-Heteropentalene Serving as a Host Material for a Phosphorescent OLED
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2021-09-23
err20
PREAI
errKashida, Junki; Shoji, Yoshiaki; Ikabata, Yasuhiro; Taka, Hideo; Sakai, Hayato; Hasobe, Taku; Nakai, Hiromi; Fukushima, Takanori
err分享
err收藏
An Element-Substituted Cyclobutadiene Exhibiting High-Energy Blue Phosphorescence
errANGEWANDTE CHEMIE-INTERNATIONAL EDITION
IF16.9
err2021-07-09
err17
PREAI
errShoji, Yoshiaki; Ikabata, Yasuhiro; Ryzhii, Ivan; Ayub, Rabia; El Bakouri, Ouissam; Sato, Taiga; Wang, Qi; Miura, Tomoaki; Karunathilaka, Buddhika S. B.; Tsuchiya, Youichi; Adachi, Chihaya; Ottosson, Henrik; Nakai, Hiromi; Ikoma, Tadaaki; Fukushima, Takanori
err分享
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Assessing locally range-separated hybrid functionals from a gradient expansion of the exchange energy density
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-06-01
err15
PREAI
errMaier, Toni M.; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
err收藏
Machine-learned electron correlation model based on frozen core approximation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-11-11
err10
PREAI
errIkabata, Yasuhiro; Fujisawa, Ryo; Seino, Junji; Yoshikawa, Takeshi; Nakai, Hiromi
err分享
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Relativistic local hybrid functionals and their impact on 1s core orbital energies
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-06-02
err9
PREAI
errMaier, Toni M.; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
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Unveiling controlling factors of the S0/S1 minimum energy conical intersection (2): Application to penalty function method
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-04-13
err12
PREAI
errInamori, Mayu; Ikabata, Yasuhiro; Yoshikawa, Takeshi; Nakai, Hiromi
err分享
err收藏
Spin-flip approach within time-dependent density functional tight-binding method: Theory and applications
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2020-03-27
err15
PREAI
errInamori, Mayu; Yoshikawa, Takeshi; Ikabata, Yasuhiro; Nishimura, Yoshifumi; Nakai, Hiromi
err分享
err收藏
Restoring the iso-orbital limit of the kinetic energy density in relativistic density functional theory
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-11-07
err8
errOAAI
errMaier, Toni M.; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
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Efficient Semi-Numerical Implementation of Relativistic Exact Exchange within the Infinite-Order Two-Component Method Using a Modified Chain-of-Spheres Method
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2019-08-12
err17
PREAI
errMaier, Toni M.; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
err收藏
Machine-learned electron correlation model based on correlation energy density at complete basis set limit
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-07-09
err27
PREAI
errNudejima, Takuro; Ikabata, Yasuhiro; Seino, Junji; Yoshikawa, Takeshi; Nakai, Hiromi
err分享
err收藏
Extension and acceleration of relativistic density functional theory based on transformed density operator
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-04-22
err10
errOAAI
errIkabata, Yasuhiro; Oyama, Takuro; Hayami, Masao; Seino, Junji; Nakai, Hiromi
err分享
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Semi-local machine-learned kinetic energy density functional with third-order gradients of electron density (vol 148, 241705, 2018)
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2018-08-20
err0
errOAAI
errSeino, Junji; Kageyama, Ryo; Fujinami, Mikito; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
err收藏
Quantum chemical approach for positron annihilation spectra of atoms and molecules beyond plane-wave approximation
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2018-05-11
err6
PREAI
errIkabata, Yasuhiro; Aiba, Risa; Iwanade, Toru; Nishizawa, Hiroaki; Wang, Feng; Nakai, Hiromi
err分享
err收藏
Semi-local machine-learned kinetic energy density functional with third-order gradients of electron density具有电子密度三阶梯度的半局部机器学习动能密度泛函
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2018-03-15
err69
PREAI
errSeino, Junji; Kageyama, Ryo; Fujinami, Mikito; Ikabata, Yasuhiro; Nakai, Hiromi
err分享
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Near-infrared absorption of π-stacking columns composed of trioxotriangulene neutral radicals
errNPJ QUANTUM MATERIALS
IF6.2
err2017-06-08
err55
errOAAI
errIkabata, Yasuhiro; Wang, Qi; Yoshikawa, Takeshi; Ueda, Akira; Murata, Tsuyoshi; Kariyazono, Kazuki; Moriguchi, Miki; Okamoto, Hiroshi; Morita, Yasushi; Nakai, Hiromi
err分享
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Unveiling a New Aspect of Simple Arylboronic Esters: Long-Lived Room-Temperature Phosphorescence from Heavy-Atom-Free Molecules
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2017-02-13
err259
PREAI
errShoji, Yoshiaki; Ikabata, Yasuhiro; Wang, Qi; Nemoto, Daisuke; Sakamoto, Atsushi; Tanaka, Naoki; Seino, Junji; Nakai, Hiromi; Fukushima, Takanori
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Effect of Hartree-Fock exact exchange on intramolecular magnetic coupling constants of organic diradicalsHartree-fock精确交换对有机双自由基分子内磁耦合常数的影响
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2015-01-13
err21
PREAI
errCho, Daeheum; Ko, Kyoung Chul; Ikabata, Yasuhiro; Wakayama, Kazufumi; Yoshikawa, Takeshi; Nakai, Hiromi; Lee, Jin Yong
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研究方向

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合作期刊
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Chihaya Adachi
H 指数: 138 · 论文数: 1.3K
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H 指数: 94 · 论文数: 2.2K
N
Norbert Koch
H 指数: 85 · 论文数: 642
J
Jin Yong Lee
H 指数: 82 · 论文数: 577
T
Takanori Fukushima
H 指数: 75 · 论文数: 789
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