A generalized formulation of explicit transformations is introduced to investigate the concept of a canonical potential in both fundamental chemical and intermolecular bonding. Different classes of representative ground electronic state pairwise interatomic interactions are referenced to a single canonical potential illustrating application of explicit transformations. Specifically, accurately determined potentials of the diatomic molecules $text{H}_{text{2}}$, $text{H}_{text{2}}^{text{+}}$, HF, LiH, argon dimer, and one-dimensional dissociative coordinates in Ar-HBr, OC-HF, and $text{OC-Cl}_{text{2}}$ are investigated throughout their bound potentials. The advantages of the current formulation for accurately evaluating equilibrium dissocia...
The definition and computational aspects of the intermolecular potential energy function (hereafter...
Author Institution: Department of Chemistry, Washington State University; Environmental Molecular Sc...
The assumption that the intermolecular attractive potentials between molecules of different species ...
A canonical approach is used to investigate prototypical multi-dimensional intermolecular interactio...
A generalized formulation of explicit transformations is introduced to investigate the concept of a ...
A canonical approach is used to investigate prototypical multi-dimensional intermolecular interactio...
In previous studies, we introduced a generalized formulation for canonical transformations and spect...
A proof-of-concept for the accurate generation of multidimensional intermolecular interaction potent...
A method is developed that gives a unified perspective on the nature of a wide range of pairwise int...
Force-based canonical approaches have recently given a unified but different viewpoint on the nature...
Canonical approaches are applied to classic Morse, Lennard-Jones, and Kratzer potentials. Using the ...
The concept of chemical bonding is normally presented and simplified through two models: the covalen...
Previously adaptions of canonical approaches were applied to algebraic forms of the classic Morse, L...
The review presents the typical bonding intermolecular interactions: hydrogen bonds, halogen bonds a...
Canonical approaches are applied for investigation of the extraordinarily accurate electronic ground...
The definition and computational aspects of the intermolecular potential energy function (hereafter...
Author Institution: Department of Chemistry, Washington State University; Environmental Molecular Sc...
The assumption that the intermolecular attractive potentials between molecules of different species ...
A canonical approach is used to investigate prototypical multi-dimensional intermolecular interactio...
A generalized formulation of explicit transformations is introduced to investigate the concept of a ...
A canonical approach is used to investigate prototypical multi-dimensional intermolecular interactio...
In previous studies, we introduced a generalized formulation for canonical transformations and spect...
A proof-of-concept for the accurate generation of multidimensional intermolecular interaction potent...
A method is developed that gives a unified perspective on the nature of a wide range of pairwise int...
Force-based canonical approaches have recently given a unified but different viewpoint on the nature...
Canonical approaches are applied to classic Morse, Lennard-Jones, and Kratzer potentials. Using the ...
The concept of chemical bonding is normally presented and simplified through two models: the covalen...
Previously adaptions of canonical approaches were applied to algebraic forms of the classic Morse, L...
The review presents the typical bonding intermolecular interactions: hydrogen bonds, halogen bonds a...
Canonical approaches are applied for investigation of the extraordinarily accurate electronic ground...
The definition and computational aspects of the intermolecular potential energy function (hereafter...
Author Institution: Department of Chemistry, Washington State University; Environmental Molecular Sc...
The assumption that the intermolecular attractive potentials between molecules of different species ...