Eine Plattform für die Wissenschaft: Bauingenieurwesen, Architektur und Urbanistik
Eine Plattform für die Wissenschaft: Bauingenieurwesen, Architektur und Urbanistik
Epoxy asphalt thermo-oxidative aging molecular model construction method
The invention provides a construction method of an epoxy asphalt thermo-oxidative aging molecular model. The construction method comprises the following steps: (1) constructing an epoxy asphalt non-aging molecular model and performing relaxation on the model; (2) constructing a mixed model of oxygen atoms and unaged epoxy asphalt; (3) compiling a Perl language script, and realizing spontaneous reaction of the oxygen atoms and the epoxy asphalt mixed model through the Perl language script; and (4) stopping the program after the target number of oxygen atoms is reached, and outputting the epoxy asphalt thermo-oxidative aging molecular model. According to the method, the thermo-oxidative aging process of the epoxy asphalt is achieved through the script, the number of oxygen atoms increased in the thermo-oxidative aging process is determined according to the content change of the oxygen element, the modeling thought is consistent with the actual thermo-oxidative aging mechanism, and the epoxy asphalt thermo-oxidative aging molecular model is obtained.
本发明提供了一种环氧沥青热氧老化分子模型的构建方法，包括以下步骤：（1）构建环氧沥青未老化分子模型并对模型进行弛豫；（2）构建氧原子与未老化环氧沥青的混合模型；（3）编写Perl语言脚本，并通过Perl语言脚本实现氧原子与环氧沥青混合模型的自发反应；（4）达到目标氧原子数后程序停止，输出环氧沥青热氧老化分子模型。本发明通过脚本实现环氧沥青的热氧老化过程，依据氧元素的含量变化确定热氧老化过程中增加的氧原子数量，建模思路与实际热氧老化机理一致，得到环氧沥青热氧老化分子模型。
Epoxy asphalt thermo-oxidative aging molecular model construction method
The invention provides a construction method of an epoxy asphalt thermo-oxidative aging molecular model. The construction method comprises the following steps: (1) constructing an epoxy asphalt non-aging molecular model and performing relaxation on the model; (2) constructing a mixed model of oxygen atoms and unaged epoxy asphalt; (3) compiling a Perl language script, and realizing spontaneous reaction of the oxygen atoms and the epoxy asphalt mixed model through the Perl language script; and (4) stopping the program after the target number of oxygen atoms is reached, and outputting the epoxy asphalt thermo-oxidative aging molecular model. According to the method, the thermo-oxidative aging process of the epoxy asphalt is achieved through the script, the number of oxygen atoms increased in the thermo-oxidative aging process is determined according to the content change of the oxygen element, the modeling thought is consistent with the actual thermo-oxidative aging mechanism, and the epoxy asphalt thermo-oxidative aging molecular model is obtained.
本发明提供了一种环氧沥青热氧老化分子模型的构建方法，包括以下步骤：（1）构建环氧沥青未老化分子模型并对模型进行弛豫；（2）构建氧原子与未老化环氧沥青的混合模型；（3）编写Perl语言脚本，并通过Perl语言脚本实现氧原子与环氧沥青混合模型的自发反应；（4）达到目标氧原子数后程序停止，输出环氧沥青热氧老化分子模型。本发明通过脚本实现环氧沥青的热氧老化过程，依据氧元素的含量变化确定热氧老化过程中增加的氧原子数量，建模思路与实际热氧老化机理一致，得到环氧沥青热氧老化分子模型。
Epoxy asphalt thermo-oxidative aging molecular model construction method
一种环氧沥青热氧老化分子模型的构建方法
MIN ZHAOHUI (Autor:in) / LI MINGYUE (Autor:in) / QING YUCHI (Autor:in) / SUN YU (Autor:in) / HUANG WEI (Autor:in)
08.09.2023
Patent
Elektronische Ressource
Chinesisch
IPC:
G16C
| British Library Online Contents | 2018