Cances, E.; Mennucci, B., “Analytical derivatives for geometry optimization in solvation continuum models. I. Theory,” J. Chem. Phys., 1998, 109, 249-59. DOI: 10.1063/1.476558
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Cances, E.; Mennucci, B., “Analytical derivatives for geometry optimization in solvation continuum models. I. Theory,” J. Chem. Phys., 1998, 109, 249-59. DOI: 10.1063/1.476558