| 摘要 |
<p><P>PROBLEM TO BE SOLVED: To provide a polymer model creation method for accurately modeling crosslinkable polymer as a simple beads spring model by computer simulation for catching a polymer structure in a molecular level. <P>SOLUTION: A polymer model creation method for modeling crosslinkable polymer as a beads spring model which can be expressed with beads and spring by a computer 400 includes: introducing an FENE potential U<SP POS="POST">FENE</SP>whose potential changes in accordance with a change in a distance between connected beads, Lennard-Jones potential U<SP POS="POST">LJ</SP>whose potential changes in accordance with a change in a distance between unconnected beads and Angle potential U<SP POS="POST">ANGLE</SP>whose potential changes in accordance with a change in an angle made among the connected three beads to the simulation of the beads spring model to create a crosslinking structure model of polymer. <P>COPYRIGHT: (C)2013,JPO&INPIT</p> |
