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Multiple dimensions of spin-gapless semiconducting states in tetragonal <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mi>Sr</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>CuF</mml:mi><mml:mn>6</mml:mn></mml:msub></mml:mrow></mml:math>

Jianhua WangSchool of Physical Science and Technology, Southwest University, Chongqing 400715, ChinaHongkuan YuanSchool of Physical Science and Technology, Southwest University, Chongqing 400715, ChinaYing LiuSchool of Materials Science and Engineering, Hebei University of Technology, Tianjin 300130, ChinaXiaotian WangSchool of Physical Science and Technology, Southwest University, Chongqing 400715, ChinaGang ZhangInstitute of High Performance Computing, Agency for Science, Technology and Research (A*STAR), Singapore 138632, Singapore
2022lv
ABI

Annotatsiya

Spin-gapless semiconductors (SGSs), with intrinsic magnetism, $100%$ spin polarization, and zero-gap band crossing points, have attracted great scientific interest owing to their potential applications in spintronics. In this Letter, using first-principles calculations and symmetry analysis, we demonstrate that the realistic material ${\mathrm{Sr}}_{2}{\mathrm{CuF}}_{6}$ is a spintronic material with multiple dimensions of spin-gapless semiconducting states. Tetragonal ${\mathrm{Sr}}_{2}{\mathrm{CuF}}_{6}$ has a zero-dimensional zero-gap nodal point, a one-dimensional zero-gap nodal line, and a two-dimensional nearly zero-gap nodal surface in one spin direction. Moreover, it hosts a wide band gap in the other spin direction. Our results extend the SGS members from nodal point SGSs and nodal line SGSs to nodal surface SGSs. Furthermore, we report a SGS candidate in an experimentally realized material exhibiting different dimensions of zero-gap points in momentum space. It is hoped that spintronic materials with multiple dimensions of spin-gapless semiconducting states may have significant applications in new-generation spintronics.

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