•Find the transition state and calculate the barrier height (ΔV≠) for the following reaction and compare with the previous assignment.
reaction ：H2 + H → H + H2
method：MP2/6-31+G(d,p)
Tip: When you calculate ts, remember to calculate irc. ( input : ts , irc output : ts , irc )
•Find the transition state and calculate the barrier height (ΔV≠) for the following reaction.
reaction ：CH4 +OH․→ H2O + CH3․
method：MP2/6-31+G(d,p)
Tip: When you calculate ts, remember to calculate irc. ( input : ts , irc output : ts , irc )
•Calculate all the exercises in Chapter 11 of the Spartan 20 Tutorial and User's Guide.