Hirotoshi Mori

Kasuga, 1128551, Japan

Last Updated: 09/26/2026

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Found 17 publications

Electronic-Structure Informatics Guided Identification of Actinide/Lanthanide Selectivity Factors.

Electronic-Structure Informatics Guided Identification of Actinide/Lanthanide Selectivity Factors.

Journal: Inorganic chemistry

Published: March 28, 2026

Ligand-Induced Electronic Response Enables Predictive QM/MM Simulations.

Ligand-Induced Electronic Response Enables Predictive QM/MM Simulations.

Journal: Advanced science (Weinheim, Baden-Wurttemberg, Germany)

Published: September 28, 2025

Reconciling color purity and redox potential in electrochromic materials via electronic-state-informed molecular design.

Reconciling color purity and redox potential in electrochromic materials via electronic-state-informed molecular design.

Journal: Chemical communications (Cambridge, England)

Published: September 16, 2025

Electronic insights into the role of nuclear quantum effects in proton transfer reactions of nucleobase pairs.

Electronic insights into the role of nuclear quantum effects in proton transfer reactions of nucleobase pairs.

Journal: Physical chemistry chemical physics : PCCP

Published: April 10, 2025

Realizing Ultrafine Color Tuning of Organic Electronics Materials by Electronic State Informatics.

Realizing Ultrafine Color Tuning of Organic Electronics Materials by Electronic State Informatics.

Journal: The journal of physical chemistry letters

Published: February 27, 2025

Acidity Prediction in Arbitrary Solvents: Machine Learning Based on Semiempirical Molecular Orbital Calculation.

Acidity Prediction in Arbitrary Solvents: Machine Learning Based on Semiempirical Molecular Orbital Calculation.

Journal: The journal of physical chemistry. A

Published: February 26, 2025

Avoiding Photocyclized Degradation of Electrochromic Materials Based on Quantum Chemical Molecular Design.

Avoiding Photocyclized Degradation of Electrochromic Materials Based on Quantum Chemical Molecular Design.

Journal: The journal of physical chemistry letters

Published: August 05, 2024

Machine Learning-Boosted Design of Ionic Liquids for CO2 Absorption and Experimental Verification.

Machine Learning-Boosted Design of Ionic Liquids for CO2 Absorption and Experimental Verification.

Journal: The journal of physical chemistry. B

Published: February 24, 2023

On donor-acceptor-bridging intramolecular hydrogen bonds in NIR-TADF molecules.

On donor-acceptor-bridging intramolecular hydrogen bonds in NIR-TADF molecules.

Journal: RSC advances

Published: November 23, 2022

Electronic fluctuation difference between trimethylamine N-oxide and tert-butyl alcohol in water.

Electronic fluctuation difference between trimethylamine N-oxide and tert-butyl alcohol in water.

Journal: Scientific reports

Published: July 25, 2022

Room-Temperature Phosphorescence Emitters Exhibiting Red to Near-Infrared Emission Derived from Intermolecular Charge-Transfer Triplet States of Naphthalenediimide-Halobenzoate Triad Molecules.

Room-Temperature Phosphorescence Emitters Exhibiting Red to Near-Infrared Emission Derived from Intermolecular Charge-Transfer Triplet States of Naphthalenediimide-Halobenzoate Triad Molecules.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)

Published: June 15, 2021

Room-Temperature Phosphorescence Emitters Exhibiting Red to Near-Infrared Emission Derived from Intermolecular Charge-Transfer Triplet States of Naphthalenediimide-Halobenzoate Triad Molecules.

Room-Temperature Phosphorescence Emitters Exhibiting Red to Near-Infrared Emission Derived from Intermolecular Charge-Transfer Triplet States of Naphthalenediimide-Halobenzoate Triad Molecules.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)

Published: March 11, 2021

Showing 1-12 of 17

Last Updated: 09/26/2026