Single-junction polymer solar cells with over 10% efficiency by a novel two-dimensional donor–acceptor conjugated copolymer C Liu, C Yi, K Wang, Y Yang, RS Bhatta, M Tsige, S Xiao, X Gong ACS applied materials & interfaces 7 (8), 4928-4935, 2015 | 308 | 2015 |
Improved force field for molecular modeling of poly (3-hexylthiophene) RS Bhatta, YY Yimer, DS Perry, M Tsige The Journal of Physical Chemistry B 117 (34), 10035-10045, 2013 | 76 | 2013 |
Chain length and torsional dependence of exciton binding energies in P3HT and PTB7 conjugated polymers: A first-principles study RS Bhatta, M Tsige Polymer 55 (11), 2667-2672, 2014 | 64 | 2014 |
Conformations and torsional potentials of poly (3-hexylthiophene) oligomers: Density functional calculations up to the dodecamer RS Bhatta, YY Yimer, M Tsige, DS Perry Computational and Theoretical Chemistry 995, 36-42, 2012 | 50 | 2012 |
Molecular structure of poly (methyl methacrylate) surface. i. Combination of interface-sensitive infrared–visible sum frequency generation, molecular dynamics simulations, and … H Zhu, KC Jha, RS Bhatta, M Tsige, A Dhinojwala Langmuir 30 (39), 11609-11618, 2014 | 48 | 2014 |
Polymers Based on Benzodipyrrolidone and Naphthodipyrrolidone with Latent Hydrogen‐Bonding on the Main Chain H Zhang, K Yang, YM Chen, R Bhatta, M Tsige, SZD Cheng, Y Zhu Macromolecular Chemistry and Physics 218 (13), 1600617, 2017 | 37 | 2017 |
A brief review of Badger–Bauer rule and its validation from a first-principles approach RS Bhatta, PP Iyer, A Dhinojwala, M Tsige Modern Physics Letters B 28 (29), 1430014, 2014 | 30 | 2014 |
Nanostructures and electronic properties of a high-efficiency electron-donating polymer RS Bhatta, DS Perry, M Tsige The Journal of Physical Chemistry A 117 (47), 12628-12634, 2013 | 27 | 2013 |
Tuning range-separated DFT functionals for accurate orbital energy modeling of conjugated molecules RS Bhatta, G Pellicane, M Tsige Computational and Theoretical Chemistry 1070, 14-20, 2015 | 22 | 2015 |
Molecular dynamics simulations of relaxation in stretched PVDF nanofibers J Miao, RS Bhatta, DH Reneker, M Tsige, PL Taylor Polymer 56, 482-489, 2015 | 20 | 2015 |
Understanding the effect of heteroatoms on structural and electronic properties of conjugated polymers RS Bhatta, M Tsige Polymer 56, 293-299, 2015 | 19 | 2015 |
Correlated backbone torsional potentials in poly (3-methylthiophene) RS Bhatta, DS Perry Computational and Theoretical Chemistry 1008, 90-95, 2013 | 19 | 2013 |
Investigation of hydrogen-bonding mediated molecular packing of diketopyrrolopyrrole based donor-acceptor oligomers in the solid state K Yang, X Li, YF Huang, RS Bhatta, J Liu, M Tsige, CL Wang, SZD Cheng, ... Polymer 160, 238-245, 2019 | 17 | 2019 |
Effect of Fluorination on Electronic Properties of Polythienothiophene-co-benzodithiophenes and Their Fullerene Complexes RS Bhatta, M Tsige ACS Applied Materials & Interfaces 6 (18), 15889-15896, 2014 | 16 | 2014 |
Torsionally-induced blue shift of the band gap in poly (3-hexylthiophene) RS Bhatta, M Tsige, DS Perry Journal of Computational and Theoretical Nanoscience 11 (10), 2157-2164, 2014 | 13 | 2014 |
A comparative ab initio study of torsion–inversion coupling in CH3NH2, CH3OH2+ and CH3CH2 RS Bhatta, A Gao, DS Perry Journal of Molecular Structure: THEOCHEM 941 (1-3), 22-29, 2010 | 11 | 2010 |
Torsion–Inversion Tunneling Patterns in the CH-Stretch Vibrationally Excited States of the G12 Family of Molecules Including Methylamine MB Dawadi, RS Bhatta, DS Perry The Journal of Physical Chemistry A 117 (50), 13356-13367, 2013 | 8 | 2013 |
Understanding structural and electronic properties of dithienyl benzothiadiazole and its complex with C70 RS Bhatta, M Tsige Polymer 75, 73-77, 2015 | 7 | 2015 |
Interfacial and wetting properties of poly (3-hexylthiophene)–water systems YY Yimer, B Yang, RS Bhatta, M Tsige Chemical Physics Letters 635, 139-145, 2015 | 6 | 2015 |
Structural Dependence of Electronic Properties in A-A-D-A-A-Type Organic Solar Cell Material RS Bhatta, M Tsige International Journal of Photoenergy 2015, 1-7, 2015 | 4 | 2015 |