several iterms are found in the literatures on the calculation works
of TM system,such as:
scalar-relativistic(for example,ZORA,DKH)
quasi-relativistic(for example,pseudopotential)
two-component relativistic
one-component realtivistic
what's the relation and difference among them ?
and what levels of approximation are they at relative to
full-relativistic(also as four-component relativistic),respectively ?
thanks!
-- so let us be up and doing with a heart for any fate still pursuing and still achieving learn to labor and to waitReceived on 2005-11-30 12:35:22
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