Coupled Cluster and Equation-of-Motion Coupled Cluster Theories - Maple Application Center
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Coupled Cluster and Equation-of-Motion Coupled Cluster Theories

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Coupled cluster theory is used to find highly accurate numerical solutions to the Schrodinger equation for ground state systems. For excited state systems, equation-of-motion coupled cluster theory can be used instead. This worksheet will briefly explore coupled cluster and equation-of-motion coupled cluster theories and show some representative results. This worksheet uses the Maple Quantum Chemistry Toolbox.

Application Details

Publish Date: March 17, 2021
Created In: Maple 2020
Language: English
This application is in the following Collection:

Quantum Chemistry Toolbox

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quantum-mechanics quantum-chemistry physics chemistry

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