QuantumATK Forum

QuantumATK => General Questions and Answers => Topic started by: shank on August 28, 2009, 14:05

Title: dimer fullerene
Post by: shank on August 28, 2009, 14:05

I want to join two C60 in molecule builder.I have c60 but since there are no two terminal H so it is not possible to join two C60.So is there any way out.Please help
with regards

Title: Re: dimer fullerene
Post by: zh on August 28, 2009, 15:07

Although there are no terminal H in C60, but I think that you may artificially create the terminal H for a chosen carbon atom in C60 using the "Geometry Manager" in "Molecule Builder". And then you may use the "join" or "fusion" to make two C60 molecules be jointed together.

Title: Re: dimer fullerene
Post by: shank on August 31, 2009, 19:01

thanks.it works