Titlebook: Supercomputer Algorithms for Reactivity, Dynamics and Kinetics of Small Molecules; Antonio Laganà Book 1989 Kluwer Academic Publishers 198

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Approximate Quantum Mechanical Calculations on Molecular Energy Transfer and Predissociation,sions involving polyatomic molecules are described. Furthermore, calculations of the lifetimes for the vibrational and rotational predissociation in van der Waals molecules are also discussed. Examples of computations include rotational excitation in Ne+HF and He+CH.CN, vibrational excitation in col

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,Temperature-Dependent Rate Constants for Ion-Dipole Reactions: C+(2P) + HCl(X 1∑+),ion-dipole reactions which combines a rotationally adiabatic capture and centrifugal sudden approximation is used to obtain rotational state-selective cross sections and rate constants. . SCF (TZ2P) methods are employed to obtain the long- and short-range electronic potential energy surfaces. This s

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Charles W. Bauschlicher Jr.,Stephen R. Langhoff,Peter R. Taylorn of second-order properties, time series workers have not always believed in the literal truth of either the Gaussian or second-order specifica­ tion. They have none-the-less stressed the importance of such optimali­ ty results, probably for two main reasons: First, the results come from a rich and

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Nicholas C. Handyandard peer-review process, out of which 18 were finally accepted for publication...The volume is organized in four parts: Robustness and Recoverability, Robust Timetabling and Route Planning, Robust Planning Under Scarce Resources, and Online Planning: Delay and Disruption Management..

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Keiji Morokuma,Koichi Yamashita,Satoshi Yabushitang the notions of robustness and recoverability into a new integrated notion of . has been done in the context of railway optimization..In this paper, we review the recent algorithmic results achieved within the recoverable robustness model in order to evaluate the effectiveness of this model. To th

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