We propose a simple procedure for visualising the electron density changes (EDC) during chemical reaction, which is based on mapping of rectangular grid points stationary structure into (distorted) positions around atoms another structure. Specifically, small step along minimum energy pathway (MEP), displacement each point obtained as linear combination motion all atoms, with contribution from ...

Abstract Methyl mercaptan (CH 3 SH) is one of the S-bearing organic compounds found in interstellar medium (ISM). In this study, we investigated surface reactions solid CH SH with H atoms on amorphous water using experimental and computational methods to examine their physicochemical behavior ISM. Consequently, primary product was discovered be 4 . As studies show that dominant reaction pathway...