Path-integral techniques, optimal paths

Fig. 6.1.4 Gradient paths for 3D reconstruction from projections. Only half a hemisphere is covered by the gradient paths, because signal for negative gradient values can be acquired by time inversion in echo techniques, (a) 3D space can be covered by a set of 2D projections, so that the 2D algorithm can be applied in two steps, (b) Optimization of the point density in 3D k space requires an integral approach to 3D reconstruction from projections. Adapted from [Lail] with permission from Institute of Physics.

Integrals of Electron Repulsion Molecular Magnetic Properties Mpller-Plesset Perturbation Theory NMR Chemical Shift Computation Ab Initio Nonadiabatic Derivative Couplings Normal Modes Reaction Path Following Spectroscopy Computational Methods Time-dependent Multi-configurational Hartree Method Transition Structure Optimization Techniques. 

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