Person:
Sherrill,
C. David
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Large-scale symmetry-adapted perturbation theory computations via density fitting and Laplace transformation techniques: Investigating the fundamental forces of DNA-intercalator interactions
Density fitting and Cholesky decomposition approximations in symmetry-adapted perturbation theory: Implementation and application to probe the nature of π-π interactions in linear acenes
Challenges of laser-cooling molecular ions
Basis set consistent revision of the S22 test set of noncovalent interaction energies
Density fitting of intramonomer correlation effects in symmetry-adapted perturbation theory
Improvement of the coupled-cluster singles and doubles method via scaling same- and opposite-spin components of the double excitation correlation energy