-
19
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-
85037222074
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-
J. Chem. Phys
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W. P. Reinhard and J. E. Hunter III, J. Chem. Phys. 97
-
-
-
-
23
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0000494237
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also Refs. c9, c10, c11, JCPSA6
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J. D. Honeycutt and H. C. Andersen, J. Chem. Phys.97, 4950 (1987), and also Refs. 91011.
-
(1987)
J. Chem. Phys.
, vol.97
, pp. 4950
-
-
Honeycutt, J.D.1
Andersen, H.C.2
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25
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-
3242877566
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-
M. Schmidt, R. Kusche, W. Kronmüller, B. von Issendorf, and H. Haberland, Phys. Rev. Lett. 79, 99 (1997)
-
(1997)
Phys. Rev. Lett.
, vol.79
, pp. 99
-
-
Schmidt, M.1
Kusche, R.2
Kronmüller, W.3
von Issendorf, B.4
Haberland, H.5
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27
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-
7244250085
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-
Such a comparison has previously been attempted, but in contrast to the suggested approach, a certain approximation, e.g., the harmonic one, was used in every case to calculate the DS. See, JCPSA6
-
Such a comparison has previously been attempted, but in contrast to the suggested approach, a certain approximation, e.g., the harmonic one, was used in every case to calculate the DS. See F. G. Amar and R. S. Berry, J. Chem. Phys. 85, 5943 (1986); JCPSA6
-
(1986)
J. Chem. Phys.
, vol.85
, pp. 5943
-
-
Amar, F.G.1
Berry, R.S.2
-
33
-
-
85037214943
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-
The regular length of the checking interval was 64 time steps. Since it might happen that the system visited another isomer between two subsequent regular samples, the calculations were also conducted for the checking interval 8 times less. They showed that the number of the points wrongly attributed in the first case, as compared to the second case, did not exceed 0.1%
-
The regular length of the checking interval was 64 time steps. Since it might happen that the system visited another isomer between two subsequent regular samples, the calculations were also conducted for the checking interval 8 times less. They showed that the number of the points wrongly attributed in the first case, as compared to the second case, did not exceed 0.1%.
-
-
-
-
34
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-
85037231407
-
-
The regular value of the amplitude of scattering was 0.2 part of the mean value of atomic velocities
-
The regular value of the amplitude of scattering was 0.2 part of the mean value of atomic velocities.
-
-
-
-
36
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-
36448999446
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-
application to clusters see, JCPSA6
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In application to clusters see R. J. Hinde and R. S. Berry, J. Chem. Phys. 99, 2942 (1993).
-
(1993)
J. Chem. Phys.
, vol.99
, pp. 2942
-
-
Hinde, R.J.1
Berry, R.S.2
-
37
-
-
0000435531
-
-
our case, in addition, the Fourier expansion of the [Formula Presented] function of [Formula Presented] is applied, and a local system of coordinates with the axes coincident with the principle axes of inertia of the cluster is introduced. PLRAAN
-
T. Çagin and J. R. Ray, Phys. Rev. A 37, 247 (1988). In our case, in addition, the Fourier expansion of the δ function of L is applied, and a local system of coordinates with the axes coincident with the principle axes of inertia of the cluster is introduced
-
(1988)
Phys. Rev. A
, vol.37
, pp. 247
-
-
Çagin, T.1
Ray, J.R.2
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38
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0002679831
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R. G. A. Bone, T. W. Rowlands, N. C. Handy, and A. J. Stone, Mol. Phys. 72, 33 (1991)
-
(1991)
Mol. Phys.
, vol.72
, pp. 33
-
-
Bone, R.G.A.1
Rowlands, T.W.2
Handy, N.C.3
Stone, A.J.4
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