problem using def2-sv(p) basis


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Input file:

start 1ee2s_bp86_def2_sv_p_sp

geometry units angstrom
"82 atoms"
end

basis
O library Def2-SV(P)
H library Def2-SV(P)
C library Def2-SV(P)
P library Def2-SV(P)
Rh library "Stuttgart RSC ECP"
end

ecp
Rh library "Stuttgart RSC ECP"
end

dft
xc becke88 perdew86
iterations 5000
grid nodisk
end

driver
maxiter 6000
end

task dft energy