Question: For a closed-subshell configuration, (a) Show that the double sum in (11.80) equals Where the Coulomb and exchange integrals are defined in terms of the
(a) Show that the double sum in (11.80) equals
-1.png)
Where the Coulomb and exchange integrals are defined in terms of the n/2 different spatial orbitals Ï;
(b) Use (11.84) and the result of part (a) to derive (11.83)
n 2 n/2 J - Ki Jij = jji, K; - K,
Step by Step Solution
3.34 Rating (172 Votes )
There are 3 Steps involved in it
a For a closedsubshell configuration 1 2 1 3 4 2 n 1 n n2 Consider the Coulomb integrals in 1180 tha... View full answer
Get step-by-step solutions from verified subject matter experts
Document Format (1 attachment)
959-P-M-A-M (748).docx
120 KBs Word File
