Abstract

Monte Carlo simulations of CH 3CN and CO 2 fluid phases exhibit anisotropy in the spatial distribution functions (SDFs) that is readily interpreted by mere inspection of 2D topographical plots of the SDFs: The local structure in condensed CH 3CN and CO 2 is dominated by dimer-like arrangements. The fact that this local structure derives from (directional) electrostatic interactions is obvious from comparisons of SDF topographies obtained from simulations with and without the partial changes associated with CH 3CN and CO 2.

Talk to us

Join us for a 30 min session where you can share your feedback and ask us any queries you have

Schedule a call

Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.