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- Paper Publications
- [1] Two-component relativistic coupled-cluster methods using mean-field spin-orbit integrals. [2] Photoexcitation of light-harvesting C–P–C60 triads: A FLMO-TD-DFT study. [3] Benchmark calculations of K-edge ionization energies for first-row elements using scalar-relativi.... [4] Unitary coupled-cluster based self-consistent polarization propagator theory: A third-order formu.... [5] Evaluating electronic couplings for excited state charge transfer based on maximum occupation met.... [6] Unitary coupled-cluster based self-consistent polarization propagator theory: a quadratic unitary.... [7] An atomic mean-field spin-orbit approach within exact two-component theory for a non-perturbative.... [8] Analytic evaluation of energy first derivatives for spin–orbit coupled-cluster singles and doubl.... [9] Relativistic coupled-cluster and equation-of-motion coupled-cluster methods.
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