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- W3025659152 abstract "Abstract Due to the unique properties and diverse applications, two-dimensional (2D) nanomaterials have been widely investigated in these years. In this work, a group of new pentagonal 2D transitional-metal sulphide monolayers (MS, M = Fe, Mn, and V) are designed based on density-functional-theory (DFT) calculations. We show that all three monolayer structures are thermally, dynamically and mechanically stable. We find that FeS, MnS and VS are metallic, and FeS and MnS are also magnetic, in which the magnetic moments are contributed by the Fe and Mn atoms, respectively. We further find that these MS monolayers show high activities for hydrogen evolution reactions (HER) as the calculated Gibbs free energies are close to zero electron volt (eV), especially for FeS and VS. Our findings broaden the family of noble-metal-free two-dimensional materials, and also help to develop low cost commercial HER catalysts." @default.
- W3025659152 created "2020-05-21" @default.
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- W3025659152 date "2020-06-01" @default.
- W3025659152 modified "2023-10-02" @default.
- W3025659152 title "Design of novel pentagonal 2D transitional-metal sulphide monolayers for hydrogen evolution reaction" @default.
- W3025659152 cites W1771457526 @default.
- W3025659152 cites W1830160077 @default.
- W3025659152 cites W1973505842 @default.
- W3025659152 cites W1975190860 @default.
- W3025659152 cites W1977307971 @default.
- W3025659152 cites W1979544533 @default.
- W3025659152 cites W1981368803 @default.
- W3025659152 cites W1986147552 @default.
- W3025659152 cites W1989554193 @default.
- W3025659152 cites W1991432121 @default.
- W3025659152 cites W2009320917 @default.
- W3025659152 cites W2014451195 @default.
- W3025659152 cites W2018042172 @default.
- W3025659152 cites W2021994802 @default.
- W3025659152 cites W2022405597 @default.
- W3025659152 cites W2022714449 @default.
- W3025659152 cites W2025377899 @default.
- W3025659152 cites W2027563442 @default.
- W3025659152 cites W2031591717 @default.
- W3025659152 cites W2031985211 @default.
- W3025659152 cites W2037863567 @default.
- W3025659152 cites W2055019368 @default.
- W3025659152 cites W2075495298 @default.
- W3025659152 cites W2083222334 @default.
- W3025659152 cites W2083355552 @default.
- W3025659152 cites W2087698390 @default.
- W3025659152 cites W2118485994 @default.
- W3025659152 cites W2124317826 @default.
- W3025659152 cites W2133795748 @default.
- W3025659152 cites W2143467751 @default.
- W3025659152 cites W2155175869 @default.
- W3025659152 cites W2214476518 @default.
- W3025659152 cites W2220596051 @default.
- W3025659152 cites W2265025560 @default.
- W3025659152 cites W2270192788 @default.
- W3025659152 cites W2291686127 @default.
- W3025659152 cites W2292770293 @default.
- W3025659152 cites W2300069949 @default.
- W3025659152 cites W2322329436 @default.
- W3025659152 cites W2329389299 @default.
- W3025659152 cites W2330240442 @default.
- W3025659152 cites W2335370736 @default.
- W3025659152 cites W2335721177 @default.
- W3025659152 cites W2338108570 @default.
- W3025659152 cites W2338620906 @default.
- W3025659152 cites W2498106012 @default.
- W3025659152 cites W2511200470 @default.
- W3025659152 cites W2518186897 @default.
- W3025659152 cites W2544296470 @default.
- W3025659152 cites W2559458927 @default.
- W3025659152 cites W2566202566 @default.
- W3025659152 cites W2567745496 @default.
- W3025659152 cites W2574394697 @default.
- W3025659152 cites W2627001981 @default.
- W3025659152 cites W2661907720 @default.
- W3025659152 cites W2747805328 @default.
- W3025659152 cites W2748717829 @default.
- W3025659152 cites W2750629594 @default.
- W3025659152 cites W2752167005 @default.
- W3025659152 cites W2752200232 @default.
- W3025659152 cites W2754905868 @default.
- W3025659152 cites W2763797961 @default.
- W3025659152 cites W2799692084 @default.
- W3025659152 cites W2805050633 @default.
- W3025659152 cites W2807940691 @default.
- W3025659152 cites W2811283851 @default.
- W3025659152 cites W2890893084 @default.
- W3025659152 cites W2953139985 @default.
- W3025659152 cites W2969274804 @default.
- W3025659152 cites W2970787737 @default.
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- W3025659152 doi "https://doi.org/10.1016/j.ijhydene.2020.04.092" @default.
- W3025659152 hasPublicationYear "2020" @default.
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