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J-GLOBAL ID：200901001218293047
Update date: Jan. 30, 2024
Ohta Yasuhito
オオタ ヤスヒト | Ohta Yasuhito
Affiliation and department：
Nara Women's University
About Nara Women's University
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Job title：
Associate Professor
Research field (1)：
Basic physical chemistry
Research keywords (1)：
分子動力学 量子化学 量子波束
Research theme for competitive and other funds (3)：
2012 - 2014 Theoretical study of growth mechanism of boron nitride fullerene-like cluster using action derived molecular dynamics method
Quantum chemical molecular dynamics simulation of the self-organization reaction of nano materials
Quantum chemical molecular dynamics simulation of the self-organization reaction of nano materials
Papers (17)：
Yuki Kawamura, Yasuhito Ohta. Annihilation dynamics of a dislocation pair in graphene: Density-functional tight-binding molecular dynamics simulations and first principles study. Computational Materials Science. 2022. 205. 111224-111224
Yasuhito Ohta. Temperature-dependent BN cluster formation dynamics from a boron cluster: Density-functional tight-binding molecular dynamics simulations. Computational Materials Science. 2017. 139. 16-25
OHTA Yasuhito, Yasuhito Ohta. Possible Mechanism of BN Fullerene Formation from a Boron Cluster: Density-Functional Tight-Binding Molecular Dynamics Simulations. Journal of Computational Chemistry. 2016. 37. 886-895
Ying Wang, Xingfa Gao, Hu-Jun Qian, Yasuhito Ohta, Xiaona Wu, Gyula Eres, Keiji Morokuma, Stephan Irle. Quantum chemical simulations reveal acetylene-based growth mechanisms in the chemical vapor deposition synthesis of carbon nanotubes. CARBON. 2014. 72. 22-37
Yoshiko Okamoto, Fuyuko Kawamura, Yasuhito Ohta, Alister J. Page, Stephan Irle, Keiji Morokuma. Self-Consistent-Charge Density-Functional Tight-Binding/MD Simulation of Transition Metal Catalyst Particle Melting and Carbide Formation. JOURNAL OF COMPUTATIONAL AND THEORETICAL NANOSCIENCE. 2011. 8. 9. 1755-1763
ｍore...
MISC (31)：
OHTA Yasuhito. Temperature-dependent BN cluster formation dynamics from a boron cluster: Density-functional tight-binding molecular dynamics simulations. Computational Materials Science. 2017. 139. 16-25
Y. Ohta. Possible mechanism of BN fullerene formation from a boron cluster: Density-functional tight-binding molecular dynamics simulations. Journal of Computational Chemistry. 2016. 37. 10. 886-895
Y. Ohta. Possible Mechanism of BN Fullerene Formation from a Boron Cluster: Density-Functional Tight-Binding Molecular Dynamics Simulations. JOURNAL OF COMPUTATIONAL CHEMISTRY. 2016. 37. 10. 886-895
Ying Wang, Xingfa Gao, Hu-Jun Qian, Yasuhito Ohta, Xiaona Wu, Gyula Eres, Keiji Morokuma, Stephan Irle. Quantum chemical simulations reveal acetylene-based growth mechanisms in the chemical vapor deposition synthesis of carbon nanotubes. CARBON. 2014. 72. 22-37
Ying Wang, Xingfa Gao, Hu-Jun Qian, Yasuhito Ohta, Xiaona Wu, Gyula Eres, Keiji Morokuma, Stephan Irle. Quantum chemical simulations reveal acetylene-based growth mechanisms in the chemical vapor deposition synthesis of carbon nanotubes. CARBON. 2014. 72. 22-37
ｍore...
Professional career (1)：
博士(理学) (金沢大学)
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