Litcius/Paper detail

When Gold Is Not Enough: Platinum Standard of Quantum Chemistry with <i>N</i><sup>7</sup> Cost

Michał Lesiuk

2022Journal of Chemical Theory and Computation18 citationsDOIOpen Access PDF

Abstract

). The method retains a near-black-box nature of the conventional coupled-cluster formalism and depends on only one additional parameter that controls the accuracy.

Topics & Concepts

Coupled clusterFormalism (music)IsomerizationQuantumAmplitudeQuantum chemistryStatistical physicsPhysicsQuantum mechanicsChemistryMoleculeSupramolecular chemistryMusicalArtVisual artsCatalysisBiochemistryAdvanced Chemical Physics StudiesMolecular spectroscopy and chiralitySpectroscopy and Quantum Chemical Studies