<html><body><div style="color:#000; background-color:#fff; font-family:times new roman, new york, times, serif;font-size:12pt"><div><span><br></span></div><br><div style="font-family: times new roman, new york, times, serif; font-size: 12pt;"><div style="font-family: times new roman, new york, times, serif; font-size: 12pt;">Dear all users, <br><div id="yiv598740033"><div><div style="color:#000;background-color:#fff;font-family:times new roman, new york, times, serif;font-size:12pt;"><div id="yiv598740033"><div><div style="color:rgb(0, 0, 0);background-color:rgb(255, 255, 255);font-family:times new roman, new york, times, serif;font-size:12pt;"><div id="yiv598740033yui_3_2_0_15_132788933809440"><span></span></div><div id="yiv598740033yui_3_2_0_15_132788933809440">I'm calculating the band structure of some topological half heuslers. All of the calculations run without any error, however I found wrong result on my band structure. If somebody helps me to
correct them, I would be so thankful.</div><div id="yiv598740033yui_3_2_0_15_132788933809440">First of all, in spite of seeing the essential band inversion, the gamma7 is not drawn!</div><div id="yiv598740033yui_3_2_0_15_132788933809440">In addition, when I insert SO interaction(without spin polarization),in the absence of any error,
I don't get correct results; and when I insert SO (with spin polarization),there's some errors in lapw2!<br></div><div id="yiv598740033yui_3_2_0_15_132788933809440">I want to know if I should insert any change or further information in "band structure" step or not. Or it may be because of some wrong information in initso_lapw step?<br></div><div id="yiv598740033yui_3_2_0_15_132788933809440">thank you so much in advance<br id="yiv598740033yui_3_2_0_15_132788933809466"></div></div></div></div></div></div></div><br><br> </div> </div> </div></body></html>