TURBOMOLE Users Forum

Forum General => Miscellaneous => Topic started by: tosa on February 17, 2011, 08:05:28 AM

Title: freeh log
Post by: tosa on February 17, 2011, 08:05:28 AM

Hello together,

in the freeh.log there ist a list of equations at the end of the document.

Is there a reference for this equations?

And ist the equation for qtrans ( qtrans=(m*k*T/(2*pi))^1.5*v h/(2*pi) ) correct, i think there is missing an exponetn (-3).

Thank you, yours sincerely

Tobi

Edit: TURBOMOLE V6.1