Ken-Ichi Nomura

7PUBLICATIONS
16CO-AUTHORS
Theoretical quantum chemistrySurface water hydrologyAerospace materialsCatalysis and mechanisms of reactionsStructure and dynamics of materials
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (7)

|Jul 02, 2026
Chemical intuition on bond-dissociation energies as an emergent ability of universal machine-learning interatomic potentials.

|Jan 08, 2026
Supercritical water at ten densities from 0.1 to 1.0 gr/cc at 1000 K using ab initio molecular dynamics simulations.

Nitish Baradwaj, Ken-Ichi Nomura, Aiichiro Nakano

|Jun 20, 2025
Allegro-FM: Toward an Equivariant Foundation Model for Exascale Molecular Dynamics Simulations.

Ken-Ichi Nomura, Shinnosuke Hattori, Satoshi Ohmura

|Sep 27, 2024
Catalysis in Extreme Field Environments: A Case Study of Strongly Ionized SiO2 Nanoparticle Surfaces.

Thomas M Linker, Ritika Dagar, Alexandra Feinberg

|May 09, 2024
Molecular Autonomous Pathfinder Using Deep Reinforcement Learning.

Ken-Ichi Nomura, Ankit Mishra, Tian Sang

|Apr 03, 2024
Alkali hydroxide (LiOH, NaOH, KOH) in water: Structural and vibrational properties, including neutron scattering results.

Ruru Ma, Nitish Baradwaj, Ken-Ichi Nomura

Pageof 2

Frequent Collaborators

7 joint publications

Aiichiro Nakano

7 joint publications

Priya Vashishta

3 joint publications

Kohei Shimmura

3 joint publications

Rajiv K Kalia