$closed shells a 1-4 ( 2 ) t1 1-3 ( 2 ) h 1 ( 2 ) $open shells type=1 a 5 ( 1 ) h 2 ( 4/5 ) $roothaan 1 $rohf 5a-5a a = 0 b = 0 5a-2h a = 1 b = 2 2h-2h a = 15/16 b = 15/8