<div dir="ltr"><div><div><div><div><div><div><div><div>Hello all:<br><br></div> I am using LMP2 in Molpro to study some large molecule. I want to get more accurate results. And I noticed that there are some parameters : REXT, REXTS,<br>
</div>RESTC, REXTW that can extend the pair domain. <br></div> However, I found these parameter are not changed, if i write like this:<br><br></div> REXT=3.0<br></div><div> LMP2<br></div><div><br></div>in input file.<br>
<br></div>what should i do if i want to change REXT from 0.0 to 3.0?<br><br></div>thanks <br><br></div>Yang GUO<br></div>