| Band gaps of crystalline solids from Wannier-localization–based optimal tuning of a screened range-separated hybrid functional D Wing, G Ohad, JB Haber, MR Filip, SE Gant, JB Neaton, L Kronik Proceedings of the National Academy of Sciences 118 (34), e2104556118, 2021 | 99 | 2021 |
| 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 | 95 | 2018 |
| Comparing time-dependent density functional theory with many-body perturbation theory for semiconductors: Screened range-separated hybrids and the plus … D Wing, JB Haber, R Noff, B Barker, DA Egger, A Ramasubramaniam, ... Physical Review Materials 3 (6), 064603, 2019 | 83 | 2019 |
| Phonon screening of excitons in semiconductors: halide perovskites and beyond MR Filip, JB Haber, JB Neaton Physical review letters 127 (6), 067401, 2021 | 69 | 2021 |
| Bidirectional phonon emission in two-dimensional heterostructures triggered by ultrafast charge transfer A Sood, JB Haber, J Carlström, EA Peterson, E Barre, JD Georgaras, ... Nature Nanotechnology 18 (1), 29-35, 2023 | 31 | 2023 |
| Spin-dependent vibronic response of a carbon radical ion in two-dimensional WS2 KA Cochrane, JH Lee, C Kastl, JB Haber, T Zhang, A Kozhakhmetov, ... Nature communications 12 (1), 7287, 2021 | 30 | 2021 |
| Exciton Lifetime and Optical Line Width Profile via Exciton–Phonon Interactions: Theory and First-Principles Calculations for Monolayer MoS2 Y Chan, JB Haber, MH Naik, JB Neaton, DY Qiu, FH da Jornada, ... Nano Letters 23 (9), 3971-3977, 2023 | 29 | 2023 |
| Optimally tuned starting point for single-shot calculations of solids SE Gant, JB Haber, MR Filip, F Sagredo, D Wing, G Ohad, L Kronik, ... Physical review materials 6 (5), 053802, 2022 | 29 | 2022 |
| Phonon-induced localization of excitons in molecular crystals from first principles AM Alvertis, JB Haber, EA Engel, S Sharifzadeh, JB Neaton Physical Review Letters 130 (8), 086401, 2023 | 28 | 2023 |
| Rydberg Excitons and Trions in Monolayer MoTe2 S Biswas, A Champagne, JB Haber, S Pokawanvit, J Wong, H Akbari, ... ACS nano 17 (8), 7685-7694, 2023 | 25 | 2023 |
| Band gaps of halide perovskites from a Wannier-localized optimally tuned screened range-separated hybrid functional G Ohad, D Wing, SE Gant, AV Cohen, JB Haber, F Sagredo, MR Filip, ... Physical review materials 6 (10), 104606, 2022 | 17 | 2022 |
| Temperature-dependent radiation sensitivity and order of 70S ribosome crystals M Warkentin, JB Hopkins, JB Haber, G Blaha, RE Thorne Acta Crystallographica Section D: Biological Crystallography 70 (11), 2890-2896, 2014 | 17 | 2014 |
| Quasiparticle and Optical Properties of Carrier-Doped Monolayer MoTe2 from First Principles A Champagne, JB Haber, S Pokawanvit, DY Qiu, S Biswas, HA Atwater, ... Nano Letters 23 (10), 4274-4281, 2023 | 13 | 2023 |
| Phonon-driven femtosecond dynamics of excitons in crystalline pentacene from first principles G Cohen, JB Haber, JB Neaton, DY Qiu, S Refaely-Abramson Physical review letters 132 (12), 126902, 2024 | 12 | 2024 |
| Optical absorption spectra of metal oxides from time-dependent density functional theory and many-body perturbation theory based on optimally-tuned hybrid functionals G Ohad, SE Gant, D Wing, JB Haber, M Camarasa-Gómez, F Sagredo, ... Physical Review Materials 7 (12), 123803, 2023 | 7 | 2023 |
| Maximally localized exciton Wannier functions for solids JB Haber, DY Qiu, FH da Jornada, JB Neaton Physical Review B 108 (12), 125118, 2023 | 7 | 2023 |
| Phonon screening and dissociation of excitons at finite temperatures from first principles AM Alvertis, JB Haber, Z Li, CJN Coveney, SG Louie, MR Filip, JB Neaton Proceedings of the National Academy of Sciences 121 (30), e2403434121, 2024 | 6 | 2024 |
| Superexchange-induced valley splitting in two-dimensional transition metal dichalcogenides: A first-principles study for rational design EA Peterson, JB Haber, JB Neaton Physical Review B 104 (20), 205421, 2021 | 6 | 2021 |
| Exciton–Phonon Coupling Induces a New Pathway for Ultrafast Intralayer-to-Interlayer Exciton Transition and Interlayer Charge Transfer in WS2–MoS2 Heterostructure: A First … Y Chan, MH Naik, JB Haber, JB Neaton, SG Louie, DY Qiu, ... Nano Letters, 2024 | 4 | 2024 |
| First-principles studies of the electronic and optical properties of halide perovskites: from three to two dimensions M Filip, J Haber, J Neaton APS March Meeting Abstracts 2019, X20. 006, 2019 | 2 | 2019 |
