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Sivan Refaely-Abramson
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Excitation gaps of finite-sized systems from optimally tuned range-separated hybrid functionals
L Kronik, T Stein, S Refaely-Abramson, R Baer
Journal of Chemical Theory and Computation 8 (5), 1515-1531, 2012
8922012
Fundamental and excitation gaps in molecules of relevance for organic photovoltaics from an optimally tuned range-separated hybrid functional
S Refaely-Abramson, R Baer, L Kronik
Physical Review B 84 (7), 075144, 2011
3542011
Quasiparticle spectra from a non-empirical optimally-tuned range-separated hybrid density functional
S Refaely-Abramson, S Sharifzadeh, N Govind, J Autschbach, JB Neaton, ...
arXiv preprint arXiv:1203.2357, 2012
3052012
Gap renormalization of molecular crystals from density-functional theory
S Refaely-Abramson, S Sharifzadeh, M Jain, R Baer, JB Neaton, L Kronik
Physical Review B 88 (8), 081204, 2013
2922013
Identifying substitutional oxygen as a prolific point defect in monolayer transition metal dichalcogenides
S Barja, S Refaely-Abramson, B Schuler, DY Qiu, A Pulkin, S Wickenburg, ...
Nature communications 10 (1), 3382, 2019
2602019
Solid-state optical absorption from optimally tuned time-dependent range-separated hybrid density functional theory
S Refaely-Abramson, M Jain, S Sharifzadeh, JB Neaton, L Kronik
Physical Review B 92, 081204(R), 2015
1842015
Large Spin-Orbit Splitting of Deep In-Gap Defect States of Engineered Sulfur Vacancies in Monolayer
B Schuler, DY Qiu, S Refaely-Abramson, C Kastl, CT Chen, S Barja, ...
Physical review letters 123 (7), 076801, 2019
1752019
Theory of Chirality Induced Spin Selectivity: Progress and Challenges
F Evers, A Aharony, N Bar‐Gill, O Entin‐Wohlman, P Hedegĺrd, O Hod, ...
Advanced Materials, 2106629, 2022
1712022
Outer-valence electron spectra of prototypical aromatic heterocycles from an optimally tuned range-separated hybrid functional
DA Egger, S Weissman, S Refaely-Abramson, S Sharifzadeh, M Dauth, ...
Journal of chemical theory and computation 10 (5), 1934-1952, 2014
1542014
Defect-induced modification of low-lying excitons and valley selectivity in monolayer transition metal dichalcogenides
S Refaely-Abramson, DY Qiu, SG Louie, JB Neaton
Phys. Rev. Lett. 121 (16), 167402, 2018
1372018
The role of chalcogen vacancies for atomic defect emission in MoS2
E Mitterreiter, B Schuler, A Micevic, D Hernangómez-Pérez, K Barthelmi, ...
Nature communications 12 (1), 3822, 2021
1352021
How Substitutional Point Defects in Two-Dimensional WS2 Induce Charge Localization, Spin–Orbit Splitting, and Strain
B Schuler, JH Lee, C Kastl, KA Cochrane, CT Chen, S Refaely-Abramson, ...
ACS nano 13 (9), 10520-10534, 2019
1122019
Electronic transport via homopeptides: The role of side chains and secondary structure
L Sepunaru, S Refaely-Abramson, R Lovrinčić, Y Gavrilov, P Agrawal, ...
Journal of the American Chemical Society 137 (30), 9617-9626, 2015
1122015
Cold denaturation induces inversion of dipole and spin transfer in chiral peptide monolayers
M Eckshtain-Levi, E Capua, S Refaely-Abramson, S Sarkar, Y Gavrilov, ...
Nature communications 7 (1), 10744, 2016
1032016
Long-lived correlated triplet pairs in a π-stacked crystalline pentacene derivative
BD Folie, JB Haber, S Refaely-Abramson, JB Neaton, NS Ginsberg
Journal of the American Chemical Society 140 (6), 2326-2335, 2018
922018
Tuning electronic transport via hepta-alanine peptides junction by tryptophan doping
C Guo, X Yu, S Refaely-Abramson, L Sepunaru, T Bendikov, I Pecht, ...
Proceedings of the National Academy of Sciences 113 (39), 10785-10790, 2016
902016
Experimental and theoretical electronic structure of quinacridone
D Lüftner, S Refaely-Abramson, M Pachler, R Resel, MG Ramsey, ...
Physical Review B 90 (7), 075204, 2014
832014
Energy level alignment at molecule-metal interfaces from an optimally tuned range-separated hybrid functional
ZF Liu, DA Egger, S Refaely-Abramson, L Kronik, JB Neaton
The Journal of Chemical Physics 146 (9), 2017
772017
Rational passivation of sulfur vacancy defects in two-dimensional transition metal dichalcogenides
H Bretscher, Z Li, J Xiao, DY Qiu, S Refaely-Abramson, ...
ACS nano 15, 8780-8789, 2021
71*2021
Origins of Singlet Fission in Solid Pentacene from an ab initio Green’s Function Approach
S Refaely-Abramson, FH da Jornada, SG Louie, JB Neaton
Physical Review Letters 119 (26), 267401, 2017
682017
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