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CALCULATION METHOD OF REACTION MECHANISM AND RECORDING MEDIUM WITH THE CALCULATION METHOD RECORDED THEREON

机译:反应机理和记录介质的计算方法及其所记录的计算方法

摘要

PPROBLEM TO BE SOLVED: To provide a calculation method of a reaction mechanism capable of easily calculating a reaction process and to provide a process simulation method using thereof. PSOLUTION: In the calculation method of the reaction mechanism, the reaction process of chemical species is estimated by making atoms consisting of one or more chemical species dynamically move respectively and by dynamically calculating, many times or until an intended chemical species is obtained, to determine their state after a fixed time. In the process simulation, an optical design of the process is carried out using the above calculation method. PCOPYRIGHT: (C)2005,JPO&NCIPI
机译:<解决的问题:提供一种能够容易地计算反应过程的反应机理的计算方法,并提供一种使用其的过程模拟方法。

解决方案:在反应机理的计算方法中,通过使由一种或多种化学物质组成的原子分别动态移动并通过动态计算多次或直到获得所需的化学物质,才能估算化学物质的反应过程。 ,以确定在固定时间后的状态。在过程模拟中,使用上述计算方法对过程进行光学设计。

版权:(C)2005,JPO&NCIPI

著录项

  • 公开/公告号JP2005034843A

    专利类型

  • 公开/公告日2005-02-10

    原文格式PDF

  • 申请/专利权人 TOSHIBA CORP;

    申请/专利号JP20040232221

  • 发明设计人 SATO HIROSUKE;

    申请日2004-08-09

  • 分类号B01J19/00;

  • 国家 JP

  • 入库时间 2022-08-21 22:29:53

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