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Adsorption of Ethylamine on Silica-Supported Nickel Phosphide

机译:乙胺对二氧化硅膦镍磷化镍的吸附

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The adsorption of ethylamine on Ni_2P/SiO_2 was studied by diffuse-reflectance Fourier transform infrared (FTIR) spectroscopy, temperature-programmed desorption (TPD), and ab initio calculations. The FTIR results indicate that ethylamine is adsorbed molecularly on the freshly reduced surface, but in the form of an ethylammonium species on the fresh surface exposed to H_2S. The TPD results indicate that ethylamine is held strongly, and decomposes to release ammonia at 500 K and ethylene at 883 K. The ethylammonium species is more reactive and releases ammonia at 634 K and ethylene at 622 K. Molecular orbital calculations for the adsorbed ethylamine give good agreement between experimentally observed vibrational frequencies and calculated values. These results indicate that on the freshly reduced surface ethylamine interacts through its nitrogen lone pair with Ni sites in a Lewis acid-base manner.
机译:通过漫反射率傅里叶变换红外(FTIR)光谱,温度编程的解吸(TPD)和AB Initio计算,研究了乙胺对Ni_2P / SiO_2上的吸附。 FTIR结果表明乙胺在新鲜的表面上吸附在分子上,但以暴露于H_2S的新鲜表面上的乙基铵物种的形式。 TPD结果表明乙胺强烈保持,并分解以在883k下释放500k和乙烯的氨。乙基铵物质在634k和622k的634k和乙烯下释放氨。用于吸附的乙胺的分子轨道算法给药通过实验观察振动频率和计算值之间的良好一致性。这些结果表明,在新鲜的表面上,乙胺在路易斯酸碱的方式中通过其氮缸对与Ni位点相互作用。

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