One-electron self-interaction and the asymptotics of the Kohn-Sham potential: an impaired relation.
about
Accurate Kohn-Sham ionization potentials from scaled-opposite-spin second-order optimized effective potential methods.Long-range interactions from the many-pair expansion: A different avenue to dispersion in DFT.Computational insight into the origin of unexpected contrast in chiral markers as revealed by STM.Effect of ensemble generalization on the highest-occupied Kohn-Sham eigenvalue.A new nonempirical tuning scheme with single self-consistent field calculation: Comparison with global and IP-tuned range-separated functional.Validation of local hybrid functionals for TDDFT calculations of electronic excitation energies.
P2860
One-electron self-interaction and the asymptotics of the Kohn-Sham potential: an impaired relation.
description
2014 nî lūn-bûn
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2014年の論文
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2014年学术文章
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2014年学术文章
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2014年学术文章
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2014年学术文章
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2014年学术文章
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2014年學術文章
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2014年學術文章
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name
One-electron self-interaction ...... tential: an impaired relation.
@en
One-electron self-interaction ...... tential: an impaired relation.
@nl
type
label
One-electron self-interaction ...... tential: an impaired relation.
@en
One-electron self-interaction ...... tential: an impaired relation.
@nl
prefLabel
One-electron self-interaction ...... tential: an impaired relation.
@en
One-electron self-interaction ...... tential: an impaired relation.
@nl
P2860
P356
P1476
One-electron self-interaction ...... otential: an impaired relation
@en
P2093
Stephan Kümmel
Tobias Schmidt
P2860
P304
14357-14367
P356
10.1039/C3CP55433C
P407
P577
2014-07-01T00:00:00Z
P5875
P698
P818
1509.00624