Eli Kraisler - Publications

Affiliations: 
Physics Tel Aviv University, Tel Aviv-Yafo, Tel Aviv District, Israel 

15 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Kocák J, Kraisler E, Schild A. Charge-Transfer Steps in Density Functional Theory from the Perspective of the Exact Electron Factorization. The Journal of Physical Chemistry Letters. 3204-3209. PMID 33761257 DOI: 10.1021/acs.jpclett.1c00467  0.408
2021 Kraisler E, Hodgson MJP, Gross EKU. From Kohn-Sham to Many-Electron Energies via Step Structures in the Exchange-Correlation Potential. Journal of Chemical Theory and Computation. PMID 33595312 DOI: 10.1021/acs.jctc.0c01093  0.482
2020 Kraisler E. Asymptotic Behavior of the Exchange‐Correlation Energy Density and the Kohn‐Sham Potential in Density Functional Theory: Exact Results and Strategy for Approximations Israel Journal of Chemistry. DOI: 10.1002/Ijch.201900103  0.576
2019 Gould T, Pittalis S, Toulouse J, Kraisler E, Kronik L. Asymptotic behavior of the Hartree-exchange and correlation potentials in ensemble density functional theory. Physical Chemistry Chemical Physics : Pccp. PMID 31490521 DOI: 10.1039/C9Cp03633D  0.635
2017 Hodgson MJP, Kraisler E, Schild A, Gross EKU. How Interatomic Steps in the Exact Kohn-Sham Potential Relate to Derivative Discontinuities of the Energy. The Journal of Physical Chemistry Letters. 8: 5974-5980. PMID 29179553 DOI: 10.1021/Acs.Jpclett.7B02615  0.495
2015 Kraisler E, Schmidt T, Kümmel S, Kronik L. Effect of ensemble generalization on the highest-occupied Kohn-Sham eigenvalue. The Journal of Chemical Physics. 143: 104105. PMID 26374016 DOI: 10.1063/1.4930119  0.583
2015 Kraisler E, Kronik L. Elimination of the asymptotic fractional dissociation problem in Kohn-Sham density-functional theory using the ensemble-generalization approach Physical Review A. 91. DOI: 10.1103/Physreva.91.032504  0.623
2014 Kraisler E, Kronik L. Fundamental gaps with approximate density functionals: the derivative discontinuity revealed from ensemble considerations. The Journal of Chemical Physics. 140: 18A540. PMID 24832348 DOI: 10.1063/1.4871462  0.601
2014 Schmidt T, Kraisler E, Makmal A, Kronik L, Kümmel S. A self-interaction-free local hybrid functional: accurate binding energies vis-à-vis accurate ionization potentials from Kohn-Sham eigenvalues. The Journal of Chemical Physics. 140: 18A510. PMID 24832318 DOI: 10.1063/1.4865942  0.553
2014 Schmidt T, Kraisler E, Kronik L, Kümmel S. One-electron self-interaction and the asymptotics of the Kohn-Sham potential: an impaired relation. Physical Chemistry Chemical Physics : Pccp. 16: 14357-67. PMID 24618904 DOI: 10.1039/C3Cp55433C  0.494
2013 Kraisler E, Kronik L. Piecewise linearity of approximate density functionals revisited: implications for frontier orbital energies. Physical Review Letters. 110: 126403. PMID 25166825 DOI: 10.1103/Physrevlett.110.126403  0.645
2013 Vilan A, Cahen D, Kraisler E. Rethinking transition voltage spectroscopy within a generic Taylor expansion view. Acs Nano. 7: 695-706. PMID 23236949 DOI: 10.1021/Nn3049686  0.346
2013 Argaman U, Makov G, Kraisler E. Higher ionization energies of atoms in density-functional theory Physical Review A. 88: 42504. DOI: 10.1103/Physreva.88.042504  0.64
2010 Kraisler E, Makov G, Kelson I. Ensemble v-representable ab-initio density-functional calculation of energy and spin in atoms: a test of exchange-correlation approximations. Physical Review A. 82. DOI: 10.1103/Physreva.82.042516  0.65
2009 Kraisler E, Makov G, Argaman N, Kelson I. Fractional occupation in Kohn-Sham density-functional theory and the treatment of non-pure-state v-representable densities Physical Review A. 80: 32115. DOI: 10.1103/Physreva.80.032115  0.598
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