Fast evaluation of scaled opposite spin second-order Møller-Plesset correlation energies using auxiliary basis expansions and exploiting sparsity.

Fast evaluation of scaled opposite spin second-order Møller-Plesset correlation energies using auxiliary basis expansions and exploiting sparsity.

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http://www.wikidata.org/entity/Q46404059
Long-range-corrected hybrid density functionals including random phase approximation correlation: application to noncovalent interactions.Communication: A reduced scaling J-engine based reformulation of SOS-MP2 using graphics processing units.A fast doubly hybrid density functional method close to chemical accuracy using a local opposite spin ansatz.Atomic orbital-based SOS-MP2 with tensor hypercontraction. I. GPU-based tensor construction and exploiting sparsity.Accurate calculation of transport properties for organic molecular semiconductors with spin-component scaled MP2 and modern density functional theory methods.Analytic Derivatives of Quartic-Scaling Doubly Hybrid XYGJ-OS Functional: Theory, Implementation, and Benchmark Comparison with M06-2X and MP2 Geometries for Nonbonded Compelexes.Linear-scaling implementation of the direct random-phase approximation.The 1,4-phenylenediisocyanide dimer: gas-phase properties and insights into organic self-assembled monolayers.Orbital optimized double-hybrid density functionals.Forces and stress in second order Møller-Plesset perturbation theory for condensed phase systems within the resolution-of-identity Gaussian and plane waves approach.Linear-scaling atomic orbital-based second-order Møller-Plesset perturbation theory by rigorous integral screening criteria.Quadratic integrand double-hybrid made spin-component-scaled.
P2860

Fast evaluation of scaled opposite spin second-order Møller-Plesset correlation energies using auxiliary basis expansions and exploiting sparsity.

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http://www.wikidata.org/entity/Q46404059
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2007 nî lūn-bûn
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Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@en
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@nl
type
label
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@en
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@nl
prefLabel
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@en
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@nl
P1433
P1476
P2093
P304
P31
P356
P433
P478
P50
P577
P5875
P698
P356
P1433
P1476
Fast evaluation of scaled oppo ...... sions and exploiting sparsity.
@en
P2093
P304
P31
P356
P433
P478
P50
P577
P5875
P698