The Infona portal uses cookies, i.e. strings of text saved by a browser on the user's device. The portal can access those files and use them to remember the user's data, such as their chosen settings (screen view, interface language, etc.), or their login data. By using the Infona portal the user accepts automatic saving and using this information for portal operation purposes. More information on the subject can be found in the Privacy Policy and Terms of Service. By closing this window the user confirms that they have read the information on cookie usage, and they accept the privacy policy and the way cookies are used by the portal. You can change the cookie settings in your browser.
By employing accurate state‐of‐the‐art many‐electron quantum‐chemistry methods, we establish that monocyclic carbon rings can accommodate Li guest atoms. The low‐lying electronic states of these endocircular systems are analyzed and found to include both charge‐separated states where the guest Li atom appears as a cation and the ring as an anion and encircled‐electron states where Li and the ring...
Direct oxidation of methane to methanol (DMTM) is a big challenge in C1 chemistry. We present a continuous N2O‐DMTM investigation by simultaneously introducing 10 vol % H2O into the reaction system over Cu‐BEA zeolites. Combining a D2O isotopic tracer technique and ab initio molecular dynamics (AIMD) simulation, we for the first time demonstrate that the H2O molecules can participate in the reaction...
Set the date range to filter the displayed results. You can set a starting date, ending date or both. You can enter the dates manually or choose them from the calendar.