most citedSome implications of the Hartree product treatment of the quantum nuclei in the ab initio Nuclear-electronic orbital methodology

4 citations · 4 across the 1 of their papers we have counts for

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2 papers

physics.chem-ph2016

Incorporating nuclear vibrational energies into the -atom in molecules- analysis: An analytical study

Masumeh Gharabaghi, Shant Shahbazian

The quantum theory of atoms in molecules (QTAIM) is based on the clamped nucleus paradigm and solely working with the electronic wavefunctions, so does not include nuclear vibratio…

physics.chem-ph2016★ 4 cited

Some implications of the Hartree product treatment of the quantum nuclei in the ab initio Nuclear-electronic orbital methodology

Masumeh Gharabaghi, Shant Shahbazian

In this letter the conceptual and computational implications of the Hartree product type nuclear wavefunction introduced recently within the context of the ab initio non-Born-Oppen…