| Fermi-Löwdin orbital self-interaction correction using the strongly constrained and appropriately normed meta-GGA functional Y Yamamoto, CM Diaz, L Basurto, KA Jackson, T Baruah, RR Zope The Journal of chemical physics 151 (15), 2019 | 64 | 2019 |
| Self-interaction corrections applied to Mg-porphyrin, C60, and pentacene molecules MR Pederson, T Baruah, D Kao, L Basurto The Journal of chemical physics 144 (16), 2016 | 55 | 2016 |
| Fermi-Löwdin orbital self-interaction correction to magnetic exchange couplings RP Joshi, K Trepte, KPK Withanage, K Sharkas, Y Yamamoto, L Basurto, ... The Journal of Chemical Physics 149 (16), 2018 | 45 | 2018 |
| The electronic structure and charge transfer excited states of the endohedral trimetallic nitride C 80 (I h) fullerenes–Zn-tetraphenyl porphyrin dyads L Basurto, F Amerikheirabadi, R Zope, T Baruah Physical Chemistry Chemical Physics 17 (8), 5832-5839, 2015 | 28 | 2015 |
| Site specific atomic polarizabilities in endohedral fullerenes and carbon onions RR Zope, S Bhusal, L Basurto, T Baruah, K Jackson The Journal of Chemical Physics 143 (8), 2015 | 17 | 2015 |
| The effect of structural changes on charge transfer states in a light-harvesting carotenoid-diaryl-porphyrin-C60 molecular triad M Olguin, L Basurto, RR Zope, T Baruah The Journal of Chemical Physics 140 (20), 2014 | 15 | 2014 |
| Self-interaction-corrected Kohn–Sham effective potentials using the density-consistent effective potential method CM Diaz, L Basurto, S Adhikari, Y Yamamoto, A Ruzsinszky, T Baruah, ... The Journal of Chemical Physics 155 (6), 2021 | 13 | 2021 |
| Self-interaction correction to density functional approximations using Fermi-Löwdin orbitals: Methodology and parallelization Y Yamamoto, L Basurto, CM Diaz, RR Zope, T Baruah Unpublished. D 68, 2840-2847, 1999 | 10 | 1999 |
| FLOSIC 0.2, based on the NRLMOL code of MR Pederson RR Zope, T Baruah, Y Yamamoto, L Basurto, CM Diaz, JE Peralta, ... The code is available to download at https://github. com/FLOSIC …, 2022 | 9 | 2022 |
| Density functional study of the electronic structure of dye-functionalized fullerenes and their model donor-acceptor complexes containing P3HT T Baruah, A Garnica, M Paggen, L Basurto, RR Zope The Journal of Chemical Physics 144 (14), 2016 | 7 | 2016 |
| Density functional investigation of the electronic structure and charge transfer excited states of a multichromophoric antenna L Basurto, RR Zope, T Baruah Chemical Physics 469, 1-8, 2016 | 3 | 2016 |
| Self-Interaction correction using Fermi-Lowdin orbitals: Methodology and Parallelization L Basurto, Y Yamamoto, C Diaz, T Baruah, R Zope Bulletin of the American Physical Society 65, 2020 | | 2020 |
| Kohn-Sham effective potentials from FLOSIC using Ryabinkin-Kohut-Staroverov method C Diaz, L Basurto, R Zope Bulletin of the American Physical Society 65, 2020 | | 2020 |
| Ionization potentials and static dipole polarizabilities of polyacenes using Fermi-Lowdin self-interaction corrected density functional approximation S Akter, Y Yamamoto, L Basurto, T Baruah, R Zope Bulletin of the American Physical Society 64, 2019 | | 2019 |
| Endohedral fullerenes contaning transition-metal clusters S Bhusal, L Basurto, R Zope, T Baruah Bulletin of the American Physical Society 62, 2017 | | 2017 |
| Dye attached fullerene and P3HT complexes A Garnica, L Basurto, R Zope, T Baruah Bulletin of the American Physical Society 60, 2015 | | 2015 |
| Electronic structure and charge transfer excitation energies of three endohedral fullerene-ZnTPP/ZnPc dyads F Amerikheirabadi, L Basurto, R Zope, T Baruah Bulletin of the American Physical Society 60, 2015 | | 2015 |
| Electronic structure and charge transfer excitation energies of a Sc N@ C -Zinc phthalocyanine (Znpc) complex F Amerikheirabadi, L Basurto, T Baruah, R Zope Bulletin of the American Physical Society 59, 2014 | | 2014 |
| Computational Search for Novel Endohedral Fullerenes L Basurto, T Baruah, R Zope Bulletin of the American Physical Society 58, 2013 | | 2013 |
| Substituent-level Tuning of Frontier Orbital Energy Levels in Phthalocyanine/C60 Donor-Acceptor Charge Transfer Pairs M Olguin, L Basurto, RR Zope, T Baruah arXiv preprint arXiv:1308.2001, 2013 | | 2013 |
Tunna BaruahUTEPVerified email at utep.edu
