Keisuke Takahashi
TitleCited byYear
Materials informatics: a journey towards material design and synthesis
K Takahashi, Y Tanaka
Dalton Transactions 45 (26), 10497-10499, 2016
222016
Chemisorption of hydrogen on fe clusters through hybrid bonding mechanisms
K Takahashi, S Isobe, S Ohnuki
Applied Physics Letters 102 (11), 113108, 2013
182013
Chemisorption of hydrogen on fe clusters through hybrid bonding mechanisms
K Takahashi, S Isobe, S Ohnuki
Applied Physics Letters 102 (11), 113108, 2013
182013
Low temperature pollutant trapping and dissociation over two-dimensional tin
L Takahashi, K Takahashi
Physical Chemistry Chemical Physics 17 (33), 21394-21396, 2015
172015
Low temperature hydrogenation of iron nanoparticles on graphene
K Takahashi, Y Wang, S Chiba, Y Nakagawa, S Isobe, S Ohnuki
Scientific reports 4, 4598, 2014
172014
The catalytic effect of Nb, NbO and Nb2O5 with different surface planes on dehydrogenation in MgH2: Density functional theory study
K Takahashi, S Isobe, S Ohnuki
Journal of Alloys and Compounds 580, S25-S28, 2013
162013
Material synthesis and design from first principle calculations and machine learning
K Takahashi, Y Tanaka
Computational Materials Science 112, 364-367, 2016
152016
Graphene decorated with Fe nanoclusters for improving the hydrogen sorption kinetics of MgH 2–experimental and theoretical evidence
MSL Hudson, K Takahashi, A Ramesh, S Awasthi, AK Ghosh, ...
Catalysis Science & Technology 6 (1), 261-268, 2016
122016
H2 Dissociation over NbO: The First Step toward Hydrogenation of Mg
K Takahashi, S Isobe, S Ohnuki
Langmuir 29 (38), 12059-12065, 2013
112013
Reversible Hydrogen Uptake by BN and BC3 Monolayers Functionalized with Small Fe Clusters: A Route to Effective Energy Storage
T Hussain, DJ Searles, K Takahashi
The Journal of Physical Chemistry A 120 (12), 2009-2013, 2016
102016
Designing square two-dimensional gold and platinum
K Takahashi, T Hussain, L Takahashi, JD Baran
Crystal Growth & Design 16 (3), 1746-1750, 2016
102016
The structural and electronic properties of small osmium clusters (2–14): A density functional theory study
K Takahashi, S Isobe, S Ohnuki
Chemical Physics Letters 555, 26-30, 2013
102013
Role of descriptors in predicting the dissolution energy of embedded oxides and the bulk modulus of oxide-embedded iron
K Takahashi, Y Tanaka
Physical Review B 95 (1), 014101, 2017
92017
Revealing the multibonding state between hydrogen and graphene-supported Ti clusters
K Takahashi, S Isobe, K Omori, T Mashoff, D Convertino, V Miseikis, ...
The Journal of Physical Chemistry C 120 (24), 12974-12979, 2016
92016
Strain field of interstitial hydrogen atom in body-centered cubic iron and its effect on hydrogen–dislocation interaction
S Wang, K Takahashi, N Hashimoto, S Isobe, S Ohnuki
Scripta Materialia 68 (5), 249-252, 2013
92013
Enhancing the hydrogen storage capacity of TiFe by utilizing clusters
K Takahashi, S Isobe
Physical Chemistry Chemical Physics 16 (31), 16765-16770, 2014
62014
The stabilization of Fe, Ru, and Os clusters upon hydrogenation
K Takahashi, S Isobe, S Ohnuki
RSC Advances 3 (44), 21841-21847, 2013
62013
Descriptors for predicting the lattice constant of body centered cubic crystal
K Takahashi, L Takahashi, JD Baran, Y Tanaka
The Journal of chemical physics 146 (20), 204104, 2017
52017
Toward Two-Dimensional Superatomic Honeycomb Structures. Evaluation of [Ge9(Si(SiMe3))3] as Source of Ge9–Cluster Building Blocks for Extended Materials
A Muņoz-Castro, K Takahashi
The Journal of Physical Chemistry C 121 (3), 1934-1940, 2017
52017
Dependence of constituent elements of AB5 type metal hydrides on hydrogenation degradation by CO2 poisoning
N Hanada, T Nakagawa, H Asada, M Ishida, K Takahashi, S Isobe, I Saita, ...
Journal of Alloys and Compounds 647, 198-203, 2015
52015
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Articles 1–20