4 results on '"Burger, Sophia"'
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2. Computation of NMR shieldings at the CASSCF level using gauge-including atomic orbitals and Cholesky decomposition.
3. NMR chemical shift computations at second-order Møller–Plesset perturbation theory using gauge-including atomic orbitals and Cholesky-decomposed two-electron integrals.
4. Cholesky decomposition of two-electron integrals in quantum-chemical calculations with perturbative or finite magnetic fields using gauge-including atomic orbitals.
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