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In molecules

Generator Coordinate Method (GCM). In molecules. In atomic nuclei. Variational principle leads to the Hill-Wheeler equation. Hamiltonian kernel. Norm kernel.

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In molecules

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  1. Generator Coordinate Method (GCM) In molecules In atomic nuclei Variational principle leads to the Hill-Wheeler equation Hamiltonian kernel Norm kernel Diagonalization of the Hamiltonian in the nonorthogonal “basis” of the generator states. The norm kernel cannot be inverted since it has zero eigenvalues!

  2. Again, we have to deal with zero eigenvalue states • Fortunately, the corresponding states lead to GCM states f0 with zero norm! • Consequently, we can restrict ourselves to states with nk>0. Symmetric orthogonalization • Since N is a norm, its eigenvalues are non-negative (nk0) • The functions uk form a complete set in the space of weight functions f(Q) Let us introduce the basis of natural states: • Those states are orthogonal • They span a sub Hilbert space called “collective” subspace (the smallest Hilbert space containing all the generating states

  3. GCM eigenstates weight functions collective vawe functions • Microscopic • Based on variational principle • Allows for a coupling between intrinsic states • Dynamics determined by the choice of Q’s • A useful point for further approximations (e.g., GOA, CSE, etc.) • Transformation to the lab system still necessary, unless the Euler (or gauge) angles are taken as collective coordinates

  4. An example: projected GCM+HF+BCS M. Bender ,H. Flocard ,P.-H. Heenen nucl-th/0305021 Usual starting point: deformed mean fields PESs and GCM eigenstates HF+BCS Projected Collective wave functions ground state SD ND

  5. The Gaussian Overlap Approximation For small values of s, one obtains: Collective momentum operator If the fluctuation in collective momentum is large, one ends up with the Gaussian shape. (Well justified for heavy systems.) Collective Hamiltonian Collective mass (collective inertia) Collective potential Zero-point energy

  6. An example: GOA+HF(B) Gogny calculations J. Libert, M. Girod, and J.-P. Delaroche Phys. Rev. C 60 , 054301 (1999) zero-point energy corrections collective levels collective wave functions

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