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
269 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
176 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
113 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
83 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 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
55 2014 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
54 2013 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 (Fe2 CrO4 ) SA Chambers, TC Droubay, TC Kaspar, IH Nayyar, ME McBriarty, ...
Advanced Functional Materials 27 (9), 1605040, 2017
29 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
19 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
14 2015 Two-photon absorption spectra predicted by semiempirical methods IH Nayyar, AE Masunov
Journal of Computational and Theoretical Nanoscience 11 (10), 2208-2220, 2014
10 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
9 2022 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
9 2012 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 Structural and Reorientational Dynamics of Tetrahydroborate (BH4-) and Tetrahydrofuran (THF) in a Mg (BH4) 2THF Adduct: Neutron-Scattering Characterization MNMN Dimitrievska, M Chong, ME Bowden, H Wu, W Zhou, I Nayyar, ...
Mirjana NMN Dimitrievska, Marina Chong, Mark E. Bowden, Hui Wu, Wei Zhou …, 2020
2020 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 Fe T Droubay, T Kaspar, I Nayyar, D Keavney, P Sushko, S Chambers
Bulletin of the American Physical Society 62, 2017
2017 
Sergei TretiakLos Alamos National LaboratoryE-mailová adresa ověřena na: lanl.gov