Finite difference approximation of control via the potential in a 1-D Schrödinger equation.
The ground-state energy and properties of any many-electron atom or molecule may be rigorously computed by variationally computing the two-electron reduced density matrix rather than the many-electron wavefunction. While early attempts fifty years ago to compute the ground-state 2-RDM directly were stymied because the 2-RDM must be constrained to represent an N-electron wavefunction, recent advances in theory and optimization have made direct computation of the 2-RDM possible. The constraints in...
We consider the Dirac-type operators D + a, a is a paravector in the Clifford algebra. For this operator we state a Cauchy-Green formula in the spaces and . Further, we consider the Cauchy problem for this operator.