{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,6]],"date-time":"2026-10-06T04:51:14Z","timestamp":1791262274372,"version":"4.1.0"},"reference-count":56,"publisher":"Wiley","license":[{"start":{"date-parts":[[2026,10,5]],"date-time":"2026-10-05T00:00:00Z","timestamp":1791158400000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"},{"start":{"date-parts":[[2026,10,5]],"date-time":"2026-10-05T00:00:00Z","timestamp":1791158400000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["advanced.onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Advanced Materials"],"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    Rechargeable magnesium batteries offer a compelling pathway toward sustainable energy storage, yet realizing this vision demands scalable electrolytes formulated with widely accessible salts, such as magnesium bis(trifluoromethanesulfonyl)imide (Mg(TFSI)\n                    <jats:sub>2<\/jats:sub>\n                    ). Progress in Mg(TFSI)\n                    <jats:sub>2<\/jats:sub>\n                    \u2010based electrolytes has been severely hindered by low Mg stripping\/plating efficiency, arising from sluggish Mg\n                    <jats:sup>2+<\/jats:sup>\n                    desolvation kinetics and uncontrolled interfacial reactions. Herein, we adopt a descriptor\u2010informed molecular screening approach and identify 4\u2010bromo\u2010N, N\u2010dimethylaniline (BrNNA) as an interface\u2010active electrolyte component that enables fast Mg stripping\/plating kinetics in Mg(TFSI)\n                    <jats:sub>2<\/jats:sub>\n                    \u2010based electrolytes. Recognizing their relevance to interface modulation, dipole moment, lowest unoccupied molecular orbital energy, and donor number are employed as quantifiable molecular descriptors to screen a series of substituted aniline derivatives, from which BrNNA emerges as the optimal candidate. The optimized BrNNA\u2010containing electrolyte supports immediate and stable Mg electrochemistry without activation, sustaining over 2400\u00a0h at 0.1\u00a0mA\u00a0cm\n                    <jats:sup>\u22122<\/jats:sup>\n                    in symmetric cells and achieving cumulative areal capacities up to 5 Ah cm\n                    <jats:sup>\u22122<\/jats:sup>\n                    at 10\u00a0mA\u00a0cm\n                    <jats:sup>\u22122<\/jats:sup>\n                    . We reveal that BrNNA participates in Mg\n                    <jats:sup>2+<\/jats:sup>\n                    solvation while preferentially adsorbing onto the Mg surface, lowering the Mg\n                    <jats:sup>2+<\/jats:sup>\n                    desolvation barrier and directing the formation of a thin Br\u2010containing interface that facilitates interfacial Mg\n                    <jats:sup>2+<\/jats:sup>\n                    transport. Moreover, the electrolyte has been validated in full Mg cells using various cathode materials.\n                  <\/jats:p>","DOI":"10.1002\/adma.75285","type":"journal-article","created":{"date-parts":[[2026,10,6]],"date-time":"2026-10-06T04:01:49Z","timestamp":1791259309000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Descriptor\u2010Informed Screening of Interface\u2010Active Molecules for Efficient Magnesium Metal Anodes"],"prefix":"10.1002","author":[{"ORCID":"https:\/\/orcid.org\/0000-0003-0876-4163","authenticated-orcid":false,"given":"Hao","family":"Xu","sequence":"first","affiliation":[{"name":"Faculty of Chemistry and Food Chemistry &amp; Center for Advancing Electronics Dresden Technische Universit\u00e4t Dresden  Dresden Germany"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yue","family":"Li","sequence":"additional","affiliation":[{"name":"Shanghai Key Laboratory of Magnetic 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