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R

Ryoichi Fukuda

Universite PSL

31H指数
120论文数
2.9K被引数
收录论文 55
发表时间
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An analysis of valence electronic structure from a viewpoint of resonance theory: Tautomerization of formamide and diazadiboretidine
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2021-06-10
err2
errOAAI
errNakatani, Kaho; Higashi, Masahiro; Fukuda, Ryoichi; Sato, Hirofumi
err分享
err收藏
Oxidation and Storage Mechanisms for Nitrogen Oxides on Variously Terminated (001) Surfaces of SrFeO3-δ and Sr3Fe2O7-δ Perovskites
errACS APPLIED MATERIALS & INTERFACES
IF8.2
err2021-02-05
err18
PREAI
errTakamatsu, Akihiko; Tamai, Kazuki; Hosokawa, Saburo; Tanaka, Tsunehiro; Ehara, Masahiro; Fukuda, Ryoichi
err分享
err收藏
Identification of hydrogen species on Pt/Al2O3 by in situ inelastic neutron scattering and their reactivity with ethylene
errCATALYSIS SCIENCE & TECHNOLOGY
IF4.2
err2021-01-01
err6
errOAAI
errYamazoe, Seiji; Yamamoto, Akira; Hosokawa, Saburo; Fukuda, Ryoichi; Hara, Kenji; Nakamura, Mitsutaka; Kamazawa, Kazuya; Tsukuda, Tatsuya; Yoshida, Hisao; Tanaka, Tsunehiro
err分享
err收藏
Quantum Chemical Computation-Driven Development of Cu-Shell-Ru-Core Nanoparticle Catalyst for NO Reduction Reaction
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2019-07-25
err5
PREAI
errOhyama, Junya; Shibano, Jumpei; Satsuma, Atsushi; Fukuda, Ryoichi; Yamamoto, Yuta; Arai, Shigeo; Shishido, Tetsuya; Asakura, Hiroyuki; Hosokawa, Saburo; Tanaka, Tsunehiro
err分享
err收藏
Catalysis of Cu Cluster for NO Reduction by CO: Theoretical Insight into the Reaction Mechanism
errACS OMEGA
IF4.3
err2019-02-04
err42
errOAAI
errTakagi, Nozomi; Ishimura, Kazuya; Miura, Hiroki; Shishido, Tetsuya; Fukuda, Ryoichi; Ehara, Masahiro; Sakaki, Shigeyoshi
err分享
err收藏
Quantum Chemical Study on the High-Pressure Effect for [4+4] Retrocycloaddition of Anthracene Cyclophane Photodimer
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2019-01-10
err7
PREAI
errFukuda, Ryoichi; Nakatani, Kaho
err分享
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Electronic Processes in NO Dimerization on Ag and Cu Clusters: DFT and MRMP2 Studies
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2018-10-31
err10
PREAI
errTakagi, Nozomi; Nakagaki, Masayuki; Ishimura, Kazuya; Fukuda, Ryoichi; Ehara, Masahiro; Sakaki, Shigeyoshi
err分享
err收藏
Photophysical Properties of Fluorescent Imaging Biological Probes of Nucleic Acids: SAC-CI and TD-DFT Study
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2018-08-24
err4
errOAAI
errShiraogawa, Takafumi; Candel, G.; Fukuda, Ryoichi; Ciofini, Ilaria; Adamo, Carlo; Okamoto, Akimitsu; Ehara, Masahiro
err分享
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Mechanism of NO-CO reaction over highly dispersed cuprous oxide on γ-alumina catalyst using a metal-support interfacial site in the presence of oxygen: similarities to and differences from biological systems
errCATALYSIS SCIENCE & TECHNOLOGY
IF4.2
err2018-01-01
err17
PREAI
errFukuda, Ryoichi; Sakai, Shogo; Takagi, Nozomi; Matsui, Masafuyu; Ehara, Masahiro; Hosokawa, Saburo; Tanaka, Tsunehiro; Sakaki, Shigeyoshi
err分享
err收藏
Synthesis and Optical Properties of Excited-State Intramolecular Proton Transfer Active π-Conjugated Benzimidazole Compounds: Influence of Structural Rigidification by Ring Fusion
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2017-11-08
err34
PREAI
errTakagi, Koji; Ito, Kaede; Yamada, Yoshihiro; Nakashima, Takuya; Fukuda, Ryoichi; Ehara, Masahiro; Masu, Hyuma
err分享
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Core-Shell versus Other Structures in Binary Cu38-n Mn Nanoclusters (M = Ru, Rh, Pd, Ag, Os, Ir, Pt, and Au; n=1, 2, and 6): Theoretical Insight into Determining Factors
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2017-05-09
err16
PREAI
errTakagi, Nozomi; Ishimura, Kazuya; Matsui, Masafuyu; Fukuda, Ryoichi; Ehara, Masahiro; Sakaki, Shigeyoshi
err分享
err收藏
Comparing the performance of TD-DFT and SAC-CI methods in the description of excited states potential energy surfaces: An excited state proton transfer reaction as case studyTd-dft和sac-ci方法在激发态势能面描述中的性能比较: 以激发态质子转移反应为例
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2017-04-13
err17
PREAI
errSavarese, Marika; Raucci, Umberto; Fukuda, Ryoichi; Adamo, Carlo; Ehara, Masahiro; Rega, Nadia; Ciofini, Ilaria
err分享
err收藏
A Theoretical Investigation on CO Oxidation by Single-Atom Catalysts M1/-Al2O3 (M=Pd, Fe, Co, and Ni)单原子催化剂M1/-Al2O3 (M = Pd，Fe，CO和Ni) 氧化Co的理论研究
errCHEMCATCHEM
IF3.9
err2017-03-16
err85
errOAAI
errYang, Tao; Fukuda, Ryoichi; Hosokawa, Saburo; Tanaka, Tsunehiro; Sakaki, Shigeyoshi; Ehara, Masahiro
err分享
err收藏
Structures of Bimetallic Copper Ruthenium Nanoparticles: Incoherent Interface and Surface Active Sites for Catalytic Nitric Oxide Dissociation
errJOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
err2017-01-04
err15
PREAI
errFukuda, Ryoichi; Takagi, Nozomi; Sakaki, Shigeyoshi; Ehara, Masahiro
err分享
err收藏
Exploring excited states using Time Dependent Density Functional Theory and density-based indexes使用时间相关的密度泛函理论和基于密度的指数探索激发态
errCOORDINATION CHEMISTRY REVIEWS
IF23.5
err2015-12-01
err120
PREAI
errAdamo, Carlo; Le Bahers, Tangui; Savarese, Marika; Wilbraham, Liam; Garcia, Gregorio; Fukuda, Ryoichi; Ehara, Masahiro; Rega, Nadia; Ciofini, Ilaria
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Projected CAP/SAC-CI Method with Smooth Voronoi Potential for Calculating Resonance States
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2015-07-21
err20
PREAI
errEhara, Masahiro; Fukuda, Ryoichi; Sommerfeld, Thomas
err分享
err收藏
Synthesis and Optical Properties of Imidazole- and Benzimidazole-Based Fused π-Conjugated Compounds: Influence of Substituent, Counteranion, and π-Conjugated System
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2015-07-08
err25
PREAI
errTakagi, Koji; Kusafuka, Kazuma; Ito, Yohei; Yamauchi, Koji; Ito, Kaede; Fukuda, Ryoichi; Ehara, Masahiro
err分享
err收藏
How Can We Understand Au8 Cores and Entangled Ligands of Selenolate- and Thiolate-Protected Gold Nanoclusters Au24(ER)20 and Au20(ER)16 (E = Se, S; R = Ph, Me)? A Theoretical Study
errJOURNAL OF THE AMERICAN CHEMICAL SOCIETY
IF15.6
err2015-06-29
err28
PREAI
errTakagi, Nozomi; Ishimura, Kazuya; Matsui, Masafuyu; Fukuda, Ryoichi; Matsui, Toni; Nakajima, Takahito; Ehara, Masahiro; Sakaki, Shigeyoshi
err分享
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Modeling Molecular Systems at Extreme Pressure by an Extension of the Polarizable Continuum Model (PCM) Based on the Symmetry-Adapted Cluster-Configuration Interaction (SAC-CI) Method: Confined Electronic Excited States of Furan as a Test Case
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2015-04-28
err31
PREAI
errFukuda, Ryoichi; Ehara, Masahiro; Cammi, Roberto
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Electronic Transitions in Conformationally Controlled Tetrasilanes with a Wide Range of SiSiSiSi Dihedral Angles (vol 20 , pg 9431, 2014)
errCHEMISTRY-A EUROPEAN JOURNAL
IF3.7
err2015-01-20
err3
PREAI
errTsuji, H.; Fogarty, H. A.; Ehara, M.; Fukuda, R.; Casher, D. L.; Tamao, K.; Nakatsuji, H.; Michl, J.
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