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Accelerated multimodel Newton-type algorithms for faster convergence of ground and excited state coupled cluster equations

scientific article published on 01 July 2020

An Orbital Invariant Similarity Constrained Coupled Cluster Model

scientific article published on 20 September 2019

Biorthonormal Formalism for Nonadiabatic Coupled Cluster Dynamics

artículo científico publicado en 2020

Efficient implementation of molecular CCSD gradients with Cholesky-decomposed electron repulsion integrals

scientific article published in 2022

Equation-of-motion coupled-cluster method with double electron-attaching operators: Theory, implementation, and benchmarks

artículo científico publicado en 2021

Linear-Scaling Implementation of Multilevel Hartree–Fock Theory

scientific article published on 08 November 2021

Multilevel CC2 and CCSD in Reduced Orbital Spaces: Electronic Excitations in Large Molecular Systems

artículo científico publicado en 2021

Spin adapted implementation of EOM-CCSD for triplet excited states: Probing intersystem crossings of acetylacetone at the carbon and oxygen K-edges

scientific article published on 01 October 2019

eT 1.0: An open source electronic structure program with emphasis on coupled cluster and multilevel methods

artículo científico publicado en 2020

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