Takahashi Group (情報化学研究室)
Takahashi Group (情報化学研究室)
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Lauren Takahashi
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Data in Materials and Catalysts Informatics
Designing Catalyst Descriptors for Machine Learning in Oxidative Coupling of Methane
Designing transformer oil immersion cooling servers for machine learning and first principle calculations
Synthesis of Heterogeneous Catalysts in Catalyst Informatics to Bridge Experiment and High-Throughput Calculation
The Rise of Catalysts Informatics
Catalysis Gene Expression Profiling: Sequencing and Designing Catalysts
Constructing catalyst knowledge networks from catalyst big data in oxidative coupling of methane for designing catalysts
Direct design of active catalysts for low temperature oxidative coupling of methane via machine learning and data mining
Extraction of catalyst design heuristics from random catalyst dataset and their utilization in catalyst development for oxidative coupling of methane
Learning catalyst design based on bias-free data set for oxidative coupling of methane
Representing catalytic and processing space in methane oxidation reaction via multioutput machine learning
rsc. li/chemical-science
Unveiling gas-phase oxidative coupling of methane via data analysis
Catalyst Acquisition by Data Science (CADS): a web-based catalyst informatics platform for discovering catalysts
Data-driven identification of the reaction network in oxidative coupling of the methane reaction via experimental data
Multidimensional classification of catalysts in oxidative coupling of methane through machine learning and high-throughput data
Representing the Methane Oxidation Reaction via Linking First-Principles Calculations and Experiment with Graph Theory
Automatic oxidation threshold recognition of XAFS data using supervised machine learning
Creating machine learning-driven material recipes based on crystal structure
Data driven determination in growth of silver from clusters to nanoparticles and bulk
High-throughput experimentation and catalyst informatics for oxidative coupling of methane
The rise of catalyst informatics: towards catalyst genomics
Visualizing scientists’ cognitive representation of materials data through the application of ontology
Electronic structure of octagonal boron nitride nanotubes
Functionalized Single-Atom-Embedded Bilayer Graphene and Hexagonal Boron Nitride
Redesigning the materials and catalysts database construction process using ontologies
Searching for hidden perovskite materials for photovoltaic systems by combining data science and first principle calculations
Tuning the Electronic Structure of an Aluminum Phosphide Nanotube through Configuration of the Lattice Geometry
Descriptors for predicting the lattice constant of body centered cubic crystal
Designing Mg7 cluster-assembled two dimensional crystal
Structural stability and electronic properties of an octagonal allotrope of two dimensional boron nitride
Designing square two-dimensional gold and platinum
Hydrophobic and antioxidant effects in In, Sn, and Sb based two dimensional materials
Prediction of the dopant activity of chemical compounds against ammonia borane with key descriptors: electronegativity and crystal structures
Reactivity of Two-Dimensional Au9, Pt9, and Au18Pt18 against Common Molecules
Low temperature pollutant trapping and dissociation over two-dimensional tin
Supporting Information- Low temperature pollutant trapping and dissociation over two-dimensional tin
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