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Calculation of C6 dispersion constants with coupled-cluster theory

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/qua.560390504openalex-snapshot
Second‐order polarization propagator calculations of dynamic dipole polarizabilities and C6 coefficients
inferredcites →https://doi.org/10.1007/bf01112569openalex-snapshot
Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
inferredcites →https://doi.org/10.1007/bf01120130openalex-snapshot
Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
inferredcites →https://doi.org/10.1016/0166-1280(91)89010-xopenalex-snapshot
Medium-size polarized basis sets for high-level-correlated calculations of molecular electric properties
inferredcites →https://doi.org/10.1016/s0065-2199(08)60054-8openalex-snapshot
Atomic and Molecular Polarizabilities-A Review of Recent Advances
inferredcites →https://doi.org/10.1021/j100257a010openalex-snapshot
AB-initio prediction of properties of carbon dioxide, ammonia, and carbon dioxide...ammonia
inferredcites →https://doi.org/10.1021/j100342a008openalex-snapshot
Coupled-cluster approach to molecular structure and spectra: a step toward predictive quantum chemistry
inferredcites →https://doi.org/10.1063/1.443164openalex-snapshot
A full coupled-cluster singles and doubles model: The inclusion of disconnected triples
inferredcites →https://doi.org/10.1063/1.449203openalex-snapshot
Bounds to two- and three-body long-range interaction coefficients for S-state atoms
inferredcites →https://doi.org/10.1063/1.450530openalex-snapshot
On the correlation between electric polarizabilities and the ionization potential of atoms
inferredcites →https://doi.org/10.1063/1.451436openalex-snapshot
Excitation energies in Be: A comparison of multiconfigurational linear response and full configuration interaction calculations
inferredcites →https://doi.org/10.1063/1.459448openalex-snapshot
C 6 dispersion coefficients in multiconfiguration self-consistent field linear response theory
inferredcites →https://doi.org/10.1063/1.461373openalex-snapshot
Analytical calculation of full configuration interaction response properties: Application to Be
inferredcites →https://doi.org/10.1080/00268976200100721openalex-snapshot
Dispersion forces
inferredcites →https://doi.org/10.1103/physrev.73.360openalex-snapshot
The Influence of Retardation on the London-van der Waals Forces
inferredcites →https://doi.org/10.1103/physreva.14.915openalex-snapshot
Finite perturbation calculation for the static dipole polarizabilities of the atoms Na through Ca
inferredcites →https://doi.org/10.1103/physreva.28.1217openalex-snapshot
Some aspects of the time-dependent coupled-cluster approach to dynamic response functions
inferredcites →https://doi.org/10.1103/physrevb.31.2539openalex-snapshot
Polarizability of alkali clusters

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

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High-intensity and ground-state influence on photoassociation line shapes of 88Sr
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Long-range dispersion coefficients for the low-lying electronic states of Mg2 from the calculation of the frequency-dependent dipole polarizabilities of Mg in its ground and excited states
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Excited states dipole polarizabilities of calcium atom and long-range dispersion coefficients for the low-lying electronic states of Ca2 and CaMg
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Intramolecular dependence of the frequency-dependent polarizabilities of K2(a3Σ+) and van der Waals dispersion coefficients for X+K2, X2+K and X2+K2 (X=Li,Na,K)
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Dispersion-Corrected Mean-Field Electronic Structure Methods
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Density Functional Response Calculations of Dispersion Coefficients C6 and C9 of Closed- and Open-Shell Systems
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Predicting Lattice Energy of Organic Crystals by Density Functional Theory with Empirically Corrected Dispersion Energy
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Corresponding States Principle for the Alkaline Earth Dimers and the van der Waals Potential of Ba2
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Exchange-hole dipole moment and the dispersion interaction
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A post-Hartree–Fock model of intermolecular interactions
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Multipolar polarizabilities of the sodium atom by a variationally stable procedure
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Theoretical spectroscopy of the calcium dimer in the AΣu+1, cΠu3, and aΣu+3 manifolds: An ab initio nonadiabatic treatment
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Dynamic polarizabilities of polyaromatic hydrocarbons using coupled-cluster linear response theory
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Relativistic electronic structure of the Sr2 molecule
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Transferability in the natural linear-scaled coupled-cluster effective Hamiltonian approach: Applications to dynamic polarizabilities and dispersion coefficients
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The ground state van der Waals potentials of the calcium dimer and calcium rare-gas complexes
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The van der Waals potential of the magnesium dimer
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A comprehensive theoretical investigation of the electronic states of Ca2 up to the Ca(4s2 S1)+Ca(4s5p P1) dissociation limit
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Influence of higher-order dispersion coefficients on near-threshold bound and continuum states: Application to ${}^{88}\text{Sr}_2$Sr288
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Rovibrational dynamics of the strontium molecule in the ${\rm A}\sideset{^1}{_{u}^{+}}{\Sigma}$AΣu+1, c3Πu, and ${\rm a}\sideset{^3}{_{u}^{+}}{\Sigma}$aΣu+3 manifold from state-of-the-art ab initio calculations
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Correlated calculations of molecular dynamic polarizabilities
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Ab initiopotential energy curves, transition dipole moments and spin–orbit coupling matrix elements for the first twenty states of the calcium dimer
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Atomic C 6 dispersion coefficients: a four-component relativistic Kohn–Sham study
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Mg–He and Ca–He van der Waals interactions: approaching the Born–Oppenheimer limit
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Double-degenerate Bose-Fermi mixture of strontium and lithium
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High-accuracy relativistic many-body calculations of van der Waals coefficients C6 for alkaline-earth-metal atoms
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Scattering length of the ground-state Mg+Mg collision
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Cold collisions of ground-state calcium atoms in a laser field: A theoretical study
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Semiempirical calculation of van der Waals coefficients for alkali-metal and alkaline-earth-metal atoms
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Dispersion coefficients for H and He interactions with alkali-metal and alkaline-earth-metal atoms
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Properties of metastable alkaline-earth-metal atoms calculated using an accurate effective core potential
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Photoassociation spectroscopy of Sr88 : Reconstruction of the wave function near the last node
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Time-dependent density-functional-theory calculation of the van der Waals coefficient C6 of alkali-metal atoms Li, Na, K; alkali-metal dimers Li2 , Na2 , K2 ; sodium clusters Nan ; and fullerene C60
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Fourier-transform spectroscopy of Sr2 and revised ground-state potential
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Hyperfine-frequency shifts of alkali-metal atoms during long-range collisions
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Empirically constructed dynamic electric dipole polarizability function of magnesium and its applications
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High-accuracy calculations of dipole, quadrupole, and octupole electric dynamic polarizabilities and van der Waals coefficients C 6, C 8, and C 10 for alkaline-earth dimers
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A Comparison of Møller-Plesset and Coupled Cluster Linear Response Theory Methods for the Calculation of Dipole Oscillator Strength Sum Rules and C6 Dispersion Coefficients
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The 1S+1S asymptote of Sr2 studied by Fourier-transform spectroscopy
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