...
首页> 外文期刊>Journal of the American Chemical Society >Extremely Shallow Valence Band in Lanthanum Trihydride
【24h】

Extremely Shallow Valence Band in Lanthanum Trihydride

机译:Extremely Shallow Valence Band in Lanthanum Trihydride

获取原文
获取原文并翻译 | 示例
           

摘要

Hydride ions (H-) in solvents are chemically active anions with strong electron-donating ability and are used as reducing agents in organic chemistry. Here, we evaluate the energy level of 1s-electrons in H- accommodated in solid lanthanum hydrides, LaHx (2 <= x <= 3), by photoemission (ultraviolet photoelectron and photoelectron yield spectros-copies) measurements and density functional theory calculations. We show that a very shallow valance band maximum with an ionization potential of 3.8 eV is attained in LaH3 and that the primary cause is attributed to the small electronegativity of hydrogen and the significant bonding-antibonding interaction between neighboring H(-)s with a close separation originating from the H-stuffed fluorite-related structure. These results encourage the challenge for p-type conduction in hydride semiconductors and provide a clue to the chemical understanding of polyhydride superconductors.

著录项

获取原文

客服邮箱:kefu@zhangqiaokeyan.com

京公网安备:11010802029741号 ICP备案号:京ICP备15016152号-6 六维联合信息科技 (北京) 有限公司©版权所有
  • 客服微信

  • 服务号