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Aliaksandr V. Krukau | Researchclopedia

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Aliaksandr V. Krukau

Indiana University Bloomington

9

Works

7,936

Citations

5

h-index

5

i10-index

Research Topics

Spectroscopy and Quantum Chemical Studies Advanced Chemical Physics Studies Molecular Junctions and Nanostructures

Affiliations

Indiana University Bloomington2011–2017

Rice University2006–2008

Top Works

Influence of the exchange screening parameter on the performance of screened hybrid functionals

Aliaksandr V. Krukau,Oleg A. Vydrov,et al.

20066,701 citations

Advanced NMR Techniques and Applications

Physics of Superconductivity and Magnetism

Importance of short-range versus long-range Hartree-Fock exchange for the performance of hybrid density functionals

Oleg A. Vydrov,Jochen Heyd,et al.

2006986 citations

Hybrid functionals with local range separation

Aliaksandr V. Krukau,Gustavo E. Scuseria,et al.

2008154 citations

Self-consistent generalized Kohn-Sham local hybrid functionals of screened exchange: Combining local and range-separated hybridization

Benjamin G. Janesko,Aliaksandr V. Krukau,et al.

200871 citations

QM:QM embedding using electronic densities within an ONIOM framework: Energies and analytic gradients

Hrant P. Hratchian,Aliaksandr V. Krukau,et al.

201128 citations

Charge redistribution in QM:QM ONIOM model systems: a constrained density functional theory approach

Daniel Beckett,Aliaksandr V. Krukau,et al.

20174 citations

Erratum: “QM:QM embedding using electronic densities within an ONIOM framework: Energies and analytic gradients” [J. Chem. Phys. 135, 014105 (2011)]

Hrant P. Hratchian,Aliaksandr V. Krukau,et al.

20121 citations

Charge redistribution in QM:QM ONIOM model systems: a constrained density functional theory approach

Daniel Beckett,Aliaksandr V. Krukau,et al.

20170 citations

New approaches for incorporating the exact exchange energy density into density functional approximations

Aliaksandr V. Krukau

20090 citations