(Q58685523)

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A Collective Description of Electron Interactions: II. CollectivevsIndividual Particle Aspects of the Interactions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A Collective Description of Electron Interactions: III. Coulomb Interactions in a Degenerate Electron Gas

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Irreversibility and Generalized Noise

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Molecular tests of the random phase approximation to the exchange-correlation energy functional

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v-representability problem

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Density-Functional Theory for Time-Dependent Systems

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Excitation Energies from Time-Dependent Density-Functional Theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

On the density matrix based approach to time-dependent density functional response theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Developing the random phase approximation into a practical post-Kohn-Sham correlation model.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

New Method for Calculating the One-Particle Green's Function with Application to the Electron-Gas Problem

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Correlation potential in density functional theory at the GWA level: Spherical atoms

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Electronic excitations: density-functional versus many-body Green’s-function approaches

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Note on an Approximation Treatment for Many-Electron Systems

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Adiabatic-connection fluctuation-dissipation density-functional theory based on range separation.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

On the equivalence of ring-coupled cluster and adiabatic connection fluctuation-dissipation theorem random phase approximation correlation energy expressions.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Third-order corrections to random-phase approximation correlation energies

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

The ground state correlation energy of the random phase approximation from a ring coupled cluster doubles approach

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A simple but fully nonlocal correction to the random phase approximation.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Long-range-corrected hybrids including random phase approximation correlation

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Hybrid functionals including random phase approximation correlation and second-order screened exchange

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Beyond the random-phase approximation for the electron correlation energy: the importance of single excitations.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Time-dependent density-functional theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Linear density response function within the time-dependent exact-exchange approximation

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

New Methods For Electronic Structure Calculations on Large Molecules

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Pseudospectral time-dependent density functional theory.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Efficient use of the resolution of the identity approximation in time-dependent density functional calculations with hybrid density functionals

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

RI-MP2: optimized auxiliary basis sets and demonstration of efficiency

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

RI-MP2: first derivatives and global consistency

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Computing $A^\alpha, \log(A)$, and Related Matrix Functions by Contour Integrals

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A Parameter-Free Density Functional That Works for Noncovalent Interactions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Stabilization energies of the hydrogen-bonded and stacked structures of nucleic acid base pairs in the crystal geometries of CG, AT, and AC DNA steps and in the NMR geometry of the 5'-d(GCGAAGC)-3' hairpin: Complete basis set calculations at the MP2

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Interactions with aromatic rings in chemical and biological recognition

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Semiempirical hybrid density functional with perturbative second-order correlation

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Origin of stability in branched alkanes

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Non-covalent interactions in biomacromolecules.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Double-hybrid density functionals with long-range dispersion corrections: higher accuracy and extended applicability

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Accurate description of van der Waals complexes by density functional theory including empirical corrections

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A density functional for sparse matter.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Power series expansion of the random phase approximation correlation energy: The role of the third- and higher-order contributions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

The role of the reference state in long-range random phase approximation correlation

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Performance of ab initio and density functional methods for conformational equilibria of C(n)H(2n+2) alkane isomers (n = 4-8).

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A thorough benchmark of density functional methods for general main group thermochemistry, kinetics, and noncovalent interactions

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Applications and validations of the Minnesota density functionals

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Basis set consistent revision of the S22 test set of noncovalent interaction energies.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Benchmark database of accurate (MP2 and CCSD(T) complete basis set limit) interaction energies of small model complexes, DNA base pairs, and amino acid pairs

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Random-phase-approximation-based correlation energy functionals: benchmark results for atoms.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Ruthenium-based heterocyclic carbene-coordinated olefin metathesis catalysts

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Mechanism and activity of ruthenium olefin metathesis catalysts

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Assessment of density functional methods for the study of olefin metathesis catalysed by ruthenium alkylidene complexes

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Benchmark Energetic Data in a Model System for Grubbs II Metathesis Catalysis and Their Use for the Development, Assessment, and Validation of Electronic Structure Methods

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Describing static correlation in bond dissociation by Kohn-Sham density functional theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Structures, C–H and C–CH3 bond energies at borders of polycyclic aromatic hydrocarbons

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A hierarchy of homodesmotic reactions for thermochemistry

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

A General Database for Main Group Thermochemistry, Kinetics, and Noncovalent Interactions - Assessment of Common and Reparameterized (meta-)GGA Density Functionals.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Accuracy of Electron Affinities of Atoms in Approximate Density Functional Theory

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Cohesive properties and asymptotics of the dispersion interaction in graphite by the random phase approximation.

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8

Asymptotics of the Dispersion Interaction: Analytic Benchmarks for van der Waals Energy Functionals

21 January 2018

1 reference

https://api.crossref.org/works/10.1007%2FS00214-011-1084-8