| An assessment of strategies for the development of solid-state adsorbents for vehicular hydrogen storage MD Allendorf, Z Hulvey, T Gennett, A Ahmed, T Autrey, J Camp, ES Cho, ... Energy & Environmental Science 11 (10), 2784-2812, 2018 | 264 | 2018 |
| Self-trapping of excitons, violation of Condon approximation, and efficient fluorescence in conjugated cycloparaphenylenes L Adamska, I Nayyar, H Chen, AK Swan, N Oldani, S Fernandez-Alberti, ... Nano letters 14 (11), 6539-6546, 2014 | 175 | 2014 |
| Localization of electronic excitations in conjugated polymers studied by DFT IH Nayyar, ER Batista, S Tretiak, A Saxena, DL Smith, RL Martin The Journal of Physical Chemistry Letters 2 (6), 566-571, 2011 | 111 | 2011 |
| Comparison of TD-DFT methods for the calculation of two-photon absorption spectra of oligophenylvinylenes IH Nayyar, AE Masunov, S Tretiak The Journal of Physical Chemistry C 117 (35), 18170-18189, 2013 | 84 | 2013 |
| Role of geometric distortion and polarization in localizing electronic excitations in conjugated polymers IH Nayyar, ER Batista, S Tretiak, A Saxena, DL Smith, RL Martin Journal of Chemical Theory and Computation 9 (2), 1144-1154, 2013 | 57 | 2013 |
| Design of a new optical material with broad spectrum linear and two-photon absorption and solvatochromism WV Moreshead, OV Przhonska, MV Bondar, AD Kachkovski, IH Nayyar, ... The Journal of Physical Chemistry C 117 (44), 23133-23147, 2013 | 55 | 2013 |
| Spectrally resolved hyperfine interactions between polaron and nuclear spins in organic light emitting diodes: Magneto-electroluminescence studies SA Crooker, F Liu, MR Kelley, NJD Martinez, W Nie, A Mohite, IH Nayyar, ... Applied Physics Letters 105 (15), 2014 | 54 | 2014 |
| Two-photon absorption spectrum of a single crystal cyanine-like dye H Hu, DA Fishman, AO Gerasov, OV Przhonska, S Webster, LA Padilha, ... The Journal of Physical Chemistry Letters 3 (9), 1222-1228, 2012 | 33 | 2012 |
| Electronic and Optical Properties of a Semiconducting Spinel (Fe2CrO4) SA Chambers, TC Droubay, TC Kaspar, IH Nayyar, ME McBriarty, ... Advanced Functional Materials 27 (9), 1605040, 2017 | 30 | 2017 |
| Physi-Sorption of H2 on Pure and Boron–Doped Graphene Monolayers: A Dispersion–Corrected DFT Study I Nayyar, B Ginovska, A Karkamkar, T Gennett, T Autrey C 6 (1), 15, 2020 | 17 | 2020 |
| Effect of trans‐and cis‐isomeric defects on the localization of the charged excitations in π‐conjugated organic polymers IH Nayyar, ER Batista, S Tretiak, A Saxena, DL Smith, RL Martin Journal of Polymer Science Part B: Polymer Physics 51 (12), 935-942, 2013 | 17 | 2013 |
| Electronic structure and optical properties of α-(Fe1-xVx) 2O3 solid-solution thin films SE Chamberlin, IH Nayyar, TC Kaspar, PV Sushko, SA Chambers Applied Physics Letters 106 (4), 2015 | 15 | 2015 |
| Two-photon absorption spectra predicted by semiempirical methods IH Nayyar, AE Masunov Journal of Computational and Theoretical Nanoscience 11 (10), 2208-2220, 2014 | 11 | 2014 |
| Analysis of Intermediates and Products from the Dehydrogenation of Mg(BH4)2 IH Nayyar, B Ginovska, M Bowden, G Edvenson, B Tran, T Autrey The Journal of Physical Chemistry A 126 (3), 444-452, 2022 | 10 | 2022 |
| Structural and reorientational dynamics of tetrahydroborate (BH 4−) and tetrahydrofuran (THF) in a Mg (BH 4) 2· 3THF adduct: Neutron-scattering characterization M Dimitrievska, M Chong, ME Bowden, H Wu, W Zhou, I Nayyar, ... Physical Chemistry Chemical Physics 22 (1), 368-378, 2020 | 8 | 2020 |
| Effect of doping and chemical ordering on the optoelectronic properties of complex oxides: Fe 2 O 3–V 2 O 3 solid solutions and hetero-structures IH Nayyar, SE Chamberlin, TC Kaspar, N Govind, SA Chambers, ... Physical Chemistry Chemical Physics 19 (2), 1097-1107, 2017 | 8 | 2017 |
| Solitonic waves in polyene dications and principles of charge carrier localization in π‐conjugated organic materials AO Gerasov, IH Nayyar, AE Masunov, OV Przhonska, OD Kachkovsky, ... International Journal of Quantum Chemistry 112 (14), 2659-2667, 2012 | 8 | 2012 |
| Bifrucation mechanisms in complex hydrides. Understanding formation of highly unstable intermediates formed in hydrogen release I Nayyar, T Autrey ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255, 2018 | | 2018 |
| Electronic, magnetic, and optical properties of Semiconducting Spinel FeCrO T Droubay, T Kaspar, I Nayyar, D Keavney, P Sushko, S Chambers Bulletin of the American Physical Society 62, 2017 | | 2017 |
| Electronic, magnetic, and optical properties of Semiconducting Spinel Fe2CrO4 T Droubay, T Kaspar, I Nayyar, D Keavney, P Sushko, S Chambers APS March Meeting Abstracts 2017, B43. 007, 2017 | | 2017 |
Sergei TretiakLos Alamos National LaboratoryVerified email at lanl.gov