Structures
a(Å)
c(Å)
Ti(1)-B/ Zr(1)-B Ti(2)-B/ Zr(2)-B Ti(2)-Al/ Zr(2)-Al Ti(1)-Ti(2)/ Ti(1)-Zr(2)/ Ti(2)-Zr(1)
△E(eV/ f.u.)
Ref
Ti3AlC2 3.075 18.578 [27]
Ti3AlC2 3.072 18.732 2.207 2.089 2.878 2.997 [32]
Tl3Al1.1C1.8 3.065 18.487 [33]
Ti3AlB2 3.138 19.549 2.264 2.193 2.924 3.163 -2.051
Ti2ZrAlB2-1 3.265 19.739 2.431 2.210 2.932 3.283 -1.880
Ti2ZrAlB2-2 3.229 19.973 2.289 2.360 3.071 3.344 -1.955