| Electronic structure and stability of semiconducting graphene nanoribbons V Barone, O Hod, GE Scuseria Nano letters 6 (12), 2748-2754, 2006 | 1926 | 2006 |
| Potassium ion batteries with graphitic materials W Luo, J Wan, B Ozdemir, W Bao, Y Chen, J Dai, H Lin, Y Xu, F Gu, ... Nano letters 15 (11), 7671-7677, 2015 | 813 | 2015 |
| Enhanced half-metallicity in edge-oxidized zigzag graphene nanoribbons O Hod, V Barone, JE Peralta, GE Scuseria Nano letters 7 (8), 2295-2299, 2007 | 610 | 2007 |
| Edge effects on the characteristics of Li diffusion in graphene C Uthaisar, V Barone Nano letters 10 (8), 2838-2842, 2010 | 440 | 2010 |
| Encyclopedia of computational chemistry P von Ragué Schleyer, NL Allinger, T Clark, J Gasteiger, P Kollman, ... J. Wiley & Sons, 1998 | 436 | 1998 |
| Magnetic boron nitride nanoribbons with tunable electronic properties V Barone, JE Peralta Nano letters 8 (8), 2210-2214, 2008 | 354 | 2008 |
| Half-metallic graphene nanodots: A comprehensive first-principles theoretical study O Hod, V Barone, GE Scuseria Physical Review B 77 (3), 035411, 2008 | 334 | 2008 |
| Enhanced electrochemical lithium storage by graphene nanoribbons T Bhardwaj, A Antic, B Pavan, V Barone, BD Fahlman Journal of the American Chemical Society 132 (36), 12556-12558, 2010 | 329 | 2010 |
| Scalable holey graphene synthesis and dense electrode fabrication toward high-performance ultracapacitors X Han, MR Funk, F Shen, YC Chen, Y Li, CJ Campbell, J Dai, X Yang, ... ACS nano 8 (8), 8255-8265, 2014 | 214 | 2014 |
| Accurate solid-state band gaps via screened hybrid electronic structure calculations EN Brothers, AF Izmaylov, JO Normand, V Barone, GE Scuseria The Journal of chemical physics 129 (1), 011102, 2008 | 195 | 2008 |
| DFT Calculation of NMR JFF Spin−Spin Coupling Constants in Fluorinated Pyridines V Barone, JE Peralta, RH Contreras, JP Snyder The Journal of Physical Chemistry A 106 (23), 5607-5612, 2002 | 181 | 2002 |
| Lithium adsorption on zigzag graphene nanoribbons C Uthaisar, V Barone, JE Peralta Journal of Applied Physics 106 (11), 113715, 2009 | 142 | 2009 |
| Accurate prediction of the electronic properties of low-dimensional graphene derivatives using a screened hybrid density functional V Barone, O Hod, JE Peralta, GE Scuseria Accounts of chemical research 44 (4), 269-279, 2011 | 127 | 2011 |
| Substituent Effects on Scalar 2J(19F,19F) and 3J(19F,19F) NMR Couplings: A Comparison of SOPPA and DFT Methods V Barone, PF Provasi, JE Peralta, JP Snyder, SPA Sauer, RH Contreras The Journal of Physical Chemistry A 107 (23), 4748-4754, 2003 | 114 | 2003 |
| Electronic properties of the biphenylene sheet and its one-dimensional derivatives MA Hudspeth, BW Whitman, V Barone, JE Peralta ACS nano 4 (8), 4565-4570, 2010 | 113 | 2010 |
| Density functional theory study of optical transitions in semiconducting single-walled carbon nanotubes V Barone, JE Peralta, M Wert, J Heyd, GE Scuseria Nano letters 5 (8), 1621-1624, 2005 | 107 | 2005 |
| Screened exchange hybrid density-functional study of the work function of pristine and doped single-walled carbon nanotubes V Barone, JE Peralta, J Uddin, GE Scuseria The Journal of chemical physics 124 (2), 024709, 2006 | 106 | 2006 |
| Through-Bond and Through-Space JFF Spin−Spin Coupling in Peridifluoronaphthalenes: Accurate DFT Evaluation of the Four Contributions JE Peralta, V Barone, RH Contreras, DG Zaccari, JP Snyder Journal of the American Chemical Society 123 (37), 9162-9163, 2001 | 103 | 2001 |
| Lithium adsorption on graphene: from isolated adatoms to metallic sheets AM Garay-Tapia, AH Romero, V Barone Journal of Chemical Theory and Computation 8 (3), 1064-1071, 2012 | 94 | 2012 |
| Machine learning the voltage of electrode materials in metal-ion batteries RP Joshi, J Eickholt, L Li, M Fornari, V Barone, JE Peralta ACS applied materials & interfaces 11 (20), 18494-18503, 2019 | 92 | 2019 |
