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Rate Calculations from Time-Dependent Wave Packet Methods: The Relationship of the Pure State and Canonical Total Reaction Probability

机译：时间依赖波包方法的速率计算：纯态与典型总反应概率的关系

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作者
Agrawal, P. M.; Agrawal, N. C.; Viswanathan, R.; Raff, L. M.;
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年度 1984
页码 p.1-7
总页数 7
原文格式 PDF
正文语种 eng
中图分类工业技术;
关键词
Computations; Wave packets; Time dependence; Rates; Theory; Numerical analysis; Reprints;

机译：计算;波包;时间依赖性;速率;理论;数值分析;重印;

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1. State specific dynamics of the H~-+H_2->H_2+H~- reaction:Energy resolved total reaction probabilities by the time-dependent wave packet method [J] . Mahapatra Susanta Physical chemistry chemical physics: PCCP . 2000,第4期

机译：H〜-+ H_2-> H_2 + H〜-反应的状态动力学：时变波包方法求解的能量总反应概率
2. RESONANCES IN HE+H-2(+)-]HEH++H REACTION IN THREE-DIMENSIONS - ENERGY RESOLVED TOTAL REACTION PROBABILITIES BY THE TIME-DEPENDENT WAVE PACKET METHOD [J] . Mahapatra S., Sathyamurthy N. The Journal of Chemical Physics . 1997,第17期

机译：三维波中HE + H-2（+）-] HEH ++ H反应的共振-能量分解总反应概率
3. Quantum wave packet calculation of reaction probabilities, cross sections, and rate constants for H++LiH -> Li+H-2(+) reaction [J] . Gogtas F International Journal of Quantum Chemistry . 2006,第9期

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4. OVULATION RATE IN PUREBRED LANDRACE AND YORKSHIRE GILTS AND ITS RELATIONSHIP WITH NUMBER OF TOTAL PIGS BORN [C] . W Tantasuparuk, M Techakumphu, S Dornin Congress of the International Pig Veterinary Society . 2002

机译：纯种Landrace和Yorkshire Gilts的排卵率及其与出生的总猪的关系
5. Quantum dynamics studies of gas-surface reactions and use of complex absorbing potentials in wave-packet calculations. [D] . Ge, Jiuyuan. 1999

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6. Accurate quantum wave packet calculations for the F + HCl → Cl + HF reaction on the ground 12A′ potential energy surface [O] . Niyazi Bulut, Jacek Kłos, Millard H. Alexander -1

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7. Accurate time-dependent wave packet calculations for the O(+) + H2 → OH(+) + H ion-molecule reaction [O] . Bulut N., Castillo J.F., Jambrina P.G., 2016

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8. Time-Dependent Wave Packet Quantum Scattering Study of the Reaction HD+(v=0-3;jo=1) + He --> HeH+(HeD+) + D(H) [R] . Tang, X., Houchins, C., Lau, K., 2007

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Rate Calculations from Time-Dependent Wave Packet Methods: The Relationship of the Pure State and Canonical Total Reaction Probability

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