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Results of search for 'au:"Ohta, Yasuhito"'
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Authors
Hammes-Schiffer, Sharon
Irle, Stephan
Kinugawa, Kenichi
Morokuma, Keiji
Ohta, Koji
Ohta, Yasuhito
Okamoto, Yoshiko
Page, Alister J
Soudackov, Alexander V
Yamane, Honami
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Computer Simulation
Crystallization
Electron Transport
Hydrogen
Iron
Macromolecular Substances
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Your search returned 8 results.
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1.
Interconversion behavior of the C-H bond in the CH4+ radical cation: ab initio molecular dynamics study.
[electronic resource]
by
Ohta, Yasuhito
Ohta, Koji
Producer:
20041122
In:
Journal of computational chemistry
vol. 25
Online resources:
Available from publisher's website
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No items available.
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2.
Ab initio centroid path integral molecular dynamics: application to vibrational dynamics of diatomic molecular systems.
[electronic resource]
by
Ohta, Yasuhito
Ohta, Koji
Kinugawa, Kenichi
Producer:
20050721
In:
The Journal of chemical physics
vol. 120
Online resources:
Available from publisher's website
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3.
Quantum effect on the internal proton transfer and structural fluctuation in the H+ 5 cluster.
[electronic resource]
by
Ohta, Yasuhito
Ohta, Koji
Kinugawa, Kenichi
Producer:
20061108
In:
The Journal of chemical physics
vol. 121
Online resources:
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4.
Rapid growth of a single-walled carbon nanotube on an iron cluster: density-functional tight-binding molecular dynamics simulations.
[electronic resource]
by
Ohta, Yasuhito
Okamoto, Yoshiko
Irle, Stephan
Morokuma, Keiji
Producer:
20090320
In:
ACS nano
vol. 2
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5.
Extended spin-boson model for nonadiabatic hydrogen tunneling in the condensed phase.
[electronic resource]
by
Ohta, Yasuhito
Soudackov, Alexander V
Hammes-Schiffer, Sharon
Producer:
20070410
In:
The Journal of chemical physics
vol. 125
Online resources:
Available from publisher's website
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6.
Mechanisms of single-walled carbon nanotube nucleation, growth, and healing determined using QM/MD methods.
[electronic resource]
by
Page, Alister J
Ohta, Yasuhito
Irle, Stephan
Morokuma, Keiji
Producer:
20110204
In:
Accounts of chemical research
vol. 43
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7.
QM/MD simulation of SWNT nucleation on transition-metal carbide nanoparticles.
[electronic resource]
by
Page, Alister J
Yamane, Honami
Ohta, Yasuhito
Irle, Stephan
Morokuma, Keiji
Producer:
20110301
In:
Journal of the American Chemical Society
vol. 132
Online resources:
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8.
Quantum chemical molecular dynamics simulation of single-walled carbon nanotube cap nucleation on an iron particle.
[electronic resource]
by
Ohta, Yasuhito
Okamoto, Yoshiko
Page, Alister J
Irle, Stephan
Morokuma, Keiji
Producer:
20100201
In:
ACS nano
vol. 3
Online resources:
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