Paul S, Ghosh S, Sanyal B
Department of Physics, Indian Institute of Technology Guwahati, Guwahati, Assam 781039, India.
J Phys Condens Matter. 2014 May 14;26(19):196004. doi: 10.1088/0953-8984/26/19/196004. Epub 2014 Apr 24.
In this article we demonstrate, by first principles density functional calculations, the emergence of spin-spiral magnetic order in Mn₂NiX(X=Al,Ga,In,Sn) inverse Heusler alloys with the application of pressure. This noncollinearity originates from the features in the band structures and the nesting of fermi surfaces of collinear spin bands. The calculated interatomic magnetic exchange parameters suggest that the frustrations in the Mn sublattice with octahedral symmetry are responsible for the stabilization of a noncollinear state. We propose that the pressure induced stabilization of spin-spiral magnetic order is a general feature of magnetic alloys crystallizing in inverse Heusler structures.
在本文中,我们通过第一性原理密度泛函计算表明,在施加压力的情况下,Mn₂NiX(X = Al、Ga、In、Sn)反赫斯勒合金中会出现自旋螺旋磁序。这种非共线性源于能带结构的特征以及共线自旋带费米面的嵌套。计算得到的原子间磁交换参数表明,具有八面体对称性的锰亚晶格中的挫折是导致非共线状态稳定的原因。我们提出,压力诱导的自旋螺旋磁序的稳定是反赫斯勒结构中结晶的磁性合金的一个普遍特征。