在金属-有机框架中通过 (II) -二复合储存环境温度
David E Jaramillo1,2, Henry Z H Jiang1,2, Hayden A Evans3
1Department of Chemistry, University of California, Berkeley, California 94720, United States.
Journal of the American Chemical Society
|April 14, 2021
概括
一个新的金属有机框架 (MOF) 在室温下强烈吸附. 这种材料为高效的燃料储存提供了一个有前途的解决方案,
科学领域:
- 材料科学
- 化学学
- 能量储存
背景情况:
- 燃料 (H2) 的实施受到储存挑战 (高压/冷温度) 的限制.
- 在运输和燃料电池应用中,有效的环境温度储至关重要.
- 任何电流吸附剂都无法满足环境H2储存的最佳结合 (-15至-25kJ/mol).
研究的目的:
- 报告一种新的金属有机框架 (MOF) 的吸附特性.
- 调查暴露金属位置的MOF对于环境储存的潜力.
- 描述MOF中的的结合机制.
主要方法:
- 气体吸附测量
- 粉末中子衍射
- 在位红外光谱学
- 电子结构计算
主要成果:
- MOF V2Cl2.8(btdd) 对H2的结合度为-21kJ/mol.
- 在相似条件下实现的可用容量超过压缩储存.
- 最短的V-D2(中心) 距离 (1.966(8) Å) 报告了MOF.
- H-H 拉伸红移 242 厘米-1 表示库巴斯型复合.
- 计算证实了通过V dπ-H2 σ*轨道相互作用的结合.
结论:
- MOF V2Cl2.8(btdd) 显示了有效的环境温度储.
- 暴露的 (II) 部位有助于强烈的可逆H2吸附.
- 具有高密度的弱π基金属位点的MOF对先进的存有希望.
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