Publications

* denotes equal contribution

  1. Space-filling curves as a novel crystal structure representation for machine learning models | pdf, link
    D. Jasrasaria, E. O. Pyzer-Knapp, D. Rappoport, A. Aspuru-Guzik, arXiv: 1608.05747 (2016).

  2. Dynamic control of explore/exploit trade-off in Bayesian optimization | pdf, link
    D. Jasrasaria, E. O. Pyzer-Knapp, Adv. in Intell. Syst. Comput. 858, 1 (2019).

  3. Sub-bandgap photoinduced transient absorption features in CdSe nanostructures: The role of trapped holes | pdf, link
    D. Jasrasaria, J. P. Philbin, C. Yan, D. Weinberg, A. P. Alivisatos, E. Rabani, J. Phys. Chem. C 124, 17372 (2020).

  4. Uncovering the role of hole traps in promoting hole transfer from multi-excitonic quantum dots to molecular acceptors | pdf, link
    C. Yan, D. Weinberg, D. Jasrasaria, M. A. Kolaczkowsi, Z.-J. Liu, J. P. Philbin, A. D. Balan, Y. Liu, A. M. Schwartzberg, E. Rabani, A. P. Alivisatos, ACS Nano 15, 2281 (2021).

  5. Dynamic lattice distortions driven by surface trapping in semiconductor nanocrystals | pdf, link
    B. Guzelturk,* B. L. Cotts,* D. Jasrasaria,* J. P. Phibin,* D. A. Hanifi, B. A. Koscher, A. D. Balan, E. Curling, M. Zajac, S. Park, N. Yazdani, C. Nyby, V. Kamysbayev, S. Fischer, Z. Nett, X. Shen, M. E. Kozina, M.-F. Lin, A. H. Reid, S. P. Weathersby, R. D. Schaller, V. Wood, X. Wang, J. A. Dionne, D. V. Talapin, A. P. Alivisatos, A. Salleo, E. Rabani, A. M. Lindenberg, Nat. Commun. 12, 1860 (2021).
    [featured in phys.org and SLAC news]

  6. Crystal structure prediction for benzene using basin-hopping global optimization | pdf, link
    A. Banerjee,* D. Jasrasaria,* S. P. Niblett, D. J. Wales, J. Phys. Chem. A 125, 3776 (2021).

  7. Interplay of surface and interior modes in exciton-phonon coupling at the nanoscale | pdf, link
    D. Jasrasaria, E. Rabani, Nano Lett. 21, 8741 (2021).

  8. Role of atomic structure on exciton dynamics and photoluminescence in NIR emissive InAs/InP/ZnSe quantum dots | pdf, link
    M. J. Enright, D. Jasrasaria, M. M. Hanchard, D. R. Needell, M. E. Phelan, D. Weinberg, B. E. McDowell, H.-W. Hsiao, H. Akbari, M. Kottwitz, M. M. Potter, J. Wong, J.-M. Zuo, H. A. Atwater, E. Rabani, R. G. Nuzzo, J. Phys. Chem. C 126, 7576 (2022).
    [featured on the cover]

  9. Simulations of nonradiative processes in semiconductor nanocrystals | pdf, link
    D. Jasrasaria, D. Weinberg, J. P. Philbin, E. Rabani, J. Chem. Phys. 157, 020901 (2022).
    [selected as a Feature Article and featured on the cover]

  10. Hybridization and deconfinement in colloidal quantum dot molecules | pdf, link
    L. Verbitsky, D. Jasrasaria, U. Banin, E. Rabani, J. Chem. Phys. 157, 134502 (2022).

  11. Ultrafast hole relaxation dynamics in quantum dots revealed by two-dimensional electronic spectroscopy | pdf, link
    P. J. Brosseau, J. J. Geuchies, D. Jasrasaria, A. J. Houtepen, E. Rabani, P. Kambhampati, Commun. Phys. 6, 48 (2023).

  12. Circumventing the phonon bottleneck by multiphonon-mediated hot exciton cooling at the nanoscale | pdf, link
    D. Jasrasaria, E. Rabani, npj Comput. Mater. 9, 145 (2023).

  13. Theory of photoluminescence spectral line shapes of semiconductor nanocrystals | pdf, link
    K. Lin, D. Jasrasaria, J. J. Yoo, M. Bawendi, H. Utzat, E. Rabani, J. Phys. Chem. Lett. 14, 7241 (2023).

  14. Development of a week-long mathematics intervention for incoming chemistry graduate students | pdf, link
    R. Clune,* A. Das,* D. Jasrasaria,* E. Rossomme, O. Cohen, A. M. Baranger, J. Chem. Ed. 100, 3291 (2023).

  15. Simulating noise on a quantum processor: Interactions between a qubit and resonant two-level system bath | pdf, link
    Y. Cho, D. Jasrasaria, K. G. Ray, D. M. Tennant, V. Lordi, J. L. DuBois, Y. J. Rosen, Quantum Sci. Technol. 8, 045023 (2023).

  16. Detecting, distinguishing, and spatiotemporally tracking photogenerated charge and heat at the nanoscale | pdf, link
    H. L. Weaver, C. M. Went, J. Wong, D. Jasrasaria, E. Rabani, H. A. Atwater, N. S. Ginsberg, ACS Nano 17, 19011 (2023).

  17. Two-dimensional electronic spectroscopy reveals dynamics within the bright fine structure of CdSe quantum dots | pdf, link
    P. Brosseau, D. Jasrasaria, A. Ghosh, H. Seiler, S. Palato, P. Kambhampati, J. Phys. Chem. Lett. 15, 1702 (2024).

  18. Nonperturbative simulation of anharmonic rattler dynamics in type-I clathrates with vibrational dynamical mean-field theory | pdf, link
    D. Jasrasaria, T. C. Berkelbach, Phys. Rev. B 110, 064312 (2024).

  19. Simulating anharmonic vibrational polaritons beyond the long wavelength approximation | pdf, link
    D. Jasrasaria, A. Mandal, D. R. Reichman, T. C. Berkelbach, J. Chem. Phys. 162, 014109 (2025).

  20. Strong anharmonicity dictates ultralow thermal conductivities of type-I clathrates | pdf, link
    D. Jasrasaria, T. C. Berkelbach, Phys. Rev. B 112, 014308 (2025).