Electric-field-gradient calculations using the projector augmented wave method HM Petrilli, PE Blöchl, P Blaha, K Schwarz Physical Review B 57 (23), 14690, 1998 | 261 | 1998 |
Nitrogen binding to the FeMo-cofactor of nitrogenase J Schimpl, HM Petrilli, PE Blöchl Journal of the American Chemical Society 125 (51), 15772-15778, 2003 | 139 | 2003 |
Hyperfine interactions in silicon quantum dots LVC Assali, HM Petrilli, RB Capaz, B Koiller, X Hu, S Das Sarma Physical Review B—Condensed Matter and Materials Physics 83 (16), 165301, 2011 | 137 | 2011 |
Structural, spectroscopic (NMR, IR, and Raman), and DFT investigation of the self-assembled nanostructure of pravastatin-LDH (layered double hydroxides) systems VRR Cunha, PAD Petersen, MB Goncalves, HM Petrilli, C Taviot-Gueho, ... Chemistry of materials 24 (8), 1415-1425, 2012 | 86 | 2012 |
Ab-initio calculations of the formation energies of BCC-based superlattices in the Fe Al system PG Gonzales-Ormeño, HM Petrilli, CG Schön Calphad 26 (4), 573-582, 2002 | 65 | 2002 |
Layered double hydroxide and sulindac coiled and scrolled nanoassemblies for storage and drug release MA Rocha, PAD Petersen, E Teixeira-Neto, HM Petrilli, F Leroux, ... Rsc Advances 6 (20), 16419-16436, 2016 | 64 | 2016 |
Delivery system for mefenamic acid based on the nanocarrier layered double hydroxide: Physicochemical characterization and evaluation of anti-inflammatory and antinociceptive … VRR Cunha, VA Guilherme, E de Paula, DR de Araujo, RO Silva, ... Materials Science and Engineering: C 58, 629-638, 2016 | 57 | 2016 |
Mefenamic acid anti-inflammatory drug: probing its polymorphs by vibrational (IR and Raman) and solid-state NMR spectroscopies VRR Cunha, CMS Izumi, PAD Petersen, A Magalhaes, MLA Temperini, ... The Journal of Physical Chemistry B 118 (16), 4333-4344, 2014 | 44 | 2014 |
Site localization of Cd impurities in sapphire GN Darriba, M Rentería, HM Petrilli, LVC Assali Physical Review B—Condensed Matter and Materials Physics 86 (7), 075203, 2012 | 40 | 2012 |
Oxindole-Schiff base copper (II) complexes interactions with human serum albumin: Spectroscopic, oxidative damage, and computational studies VC da Silveira, GF Caramori, MP Abbott, MB Gonçalves, HM Petrilli, ... Journal of inorganic biochemistry 103 (10), 1331-1341, 2009 | 38 | 2009 |
First-principles calculations for interstitial Fe impurities in hcp Sc, Y, Ti, and Zr S Frota-Pessôa, LA De Mello, HM Petrilli, AB Klautau Physical review letters 71 (25), 4206, 1993 | 38 | 1993 |
Theoretical study of hyperfine and local magnetic properties of Co and Fe clusters in fcc Ag hosts RN Nogueira, HM Petrilli Physical Review B 60 (6), 4120, 1999 | 36 | 1999 |
Real-space method for calculation of the electric field gradient in systems without symmetry HM Petrilli, S Frota-Pessôa Journal of Physics: Condensed Matter 2 (1), 135, 1990 | 36 | 1990 |
Industrial Scale Isolation, Structural and Spectroscopic Characterization of Epiisopiloturine from Pilocarpus microphyllus Stapf Leaves: A Promising Alkaloid … LMC Véras, VRR Cunha, FCDA Lima, MA Guimarães, MM Vieira, ... PLoS One 8 (6), e66702, 2013 | 35 | 2013 |
Quadrupole moments of the halogen nuclei H Haas, HM Petrilli Physical Review B 61 (20), 13588, 2000 | 34 | 2000 |
Ab initio calculation of the bcc Fe–Al phase diagram including magnetic interactions PG Gonzales-Ormeño, HM Petrilli, CG Schön Scripta materialia 54 (7), 1271-1276, 2006 | 33 | 2006 |
LAPONITE®-pilocarpine hybrid material: experimental and theoretical evaluation of pilocarpine conformation VRR Cunha, FCDA Lima, VY Sakai, LMC Véras, JRSA Leite, HM Petrilli, ... RSC advances 7 (44), 27290-27298, 2017 | 31 | 2017 |
Electric field gradients at Ta in Zr and Hf inter-metallic compounds LA Terrazos, HM Petrilli, M Marszalek, H Saitovitch, PRJ Silva, P Blaha, ... Solid state communications 121 (9-10), 525-529, 2002 | 31 | 2002 |
First-principles real-space calculations of Fe impurities in Mo and Nb HM Petrilli, S Frota-Pessôa Physical Review B 48 (10), 7148, 1993 | 29 | 1993 |
Comparative studies of oxindolimine-metal complexes as inhibitors of human DNA topoisomerase IB S Castelli, MB Gonçalves, P Katkar, GC Stuchi, RAA Couto, HM Petrilli, ... Journal of Inorganic Biochemistry 186, 85-94, 2018 | 28 | 2018 |