Erscheinungsjahr
Medientyp
Format
Lizenz
Sprache
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Efficient hybrid density functional calculations in solids: Assessment of the Heyd–Scuseria–Ernzerhof screened Coulomb hybrid functional
NationallizenzAmerican Institute of Physics | 2004| -
Linear Scaling Density Functional Calculations with Gaussian Orbitals
American Chemical Society | 1999| -
On the difference between variational and unitary coupled cluster theories
American Institute of Physics | 2018| -
Constrained active space unrestricted mean-field methods for controlling spin-contamination
NationallizenzAmerican Institute of Physics | 2011| -
Comparison of self-consistent field convergence acceleration techniques
NationallizenzAmerican Institute of Physics | 2012| -
On the difference between variational and unitary coupled cluster theories
Freier ZugriffArXiv | 2017| -
Strong correlations via constrained-pairing mean-field theory
Freier ZugriffAmerican Institute of Physics | 2009| -
Constrained-pairing mean-field theory. II. Exact treatment of dissociations to nondegenerate orbitals
NationallizenzAmerican Institute of Physics | 2009| -
Assessment of a long-range corrected hybrid functional
NationallizenzAmerican Institute of Physics | 2006| -
Assessment and validation of a screened Coulomb hybrid density functional
NationallizenzAmerican Institute of Physics | 2004| -
Analytic evaluation of energy gradients for the singles and doubles coupled cluster method including perturbative triple excitations: Theory and applications to FOOF and Cr2
NationallizenzAmerican Institute of Physics | 1991| -
The connection between self-interaction and static correlation: a random phase approximation perspective
Taylor & Francis Verlag | 2010| -
Erratum: “Hybrid functionals based on a screened Coulomb potential” [J. Chem. Phys. 118, 8207 (2003)]
Freier ZugriffAmerican Institute of Physics | 2006| -
Assessment of the Perdew–Burke–Ernzerhof exchange-correlation functional
NationallizenzAmerican Institute of Physics | 1999| -
Comparison of coupled‐cluster results with a hybrid of Hartree–Fock and density functional theory
NationallizenzAmerican Institute of Physics | 1992| -
Magnetization Dynamics from Time-Dependent Noncollinear Spin Density Functional Theory Calculations
American Chemical Society | 2015| -
On the equivalence of LIST and DIIS methods for convergence acceleration
American Institute of Physics | 2015| -
Seniority number description of potential energy surfaces: Symmetric dissociation of water, N2, C2, and Be2
American Institute of Physics | 2015| -
Linearized Jastrow-style fluctuations on spin-projected Hartree-Fock
American Institute of Physics | 2013| -
Hybrid functionals based on a screened Coulomb potential
NationallizenzAmerican Institute of Physics | 2003| -
On the equivalence of LIST and DIIS methods for convergence acceleration
Freier ZugriffArXiv | 2014| -
Electronic Structure and Stability of Semiconducting Graphene Nanoribbons
American Chemical Society | 2006| -
Robust formulation of Wick’s theorem for computing matrix elements between Hartree–Fock–Bogoliubov wavefunctions
Freier ZugriffAmerican Institute of Physics | 2023| -
Robust formulation of Wick's theorem for computing matrix elements between Hartree-Fock-Bogoliubov wavefunctions
Freier ZugriffArXiv | 2023|
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