Diesel-like Fuel Obtained by Pyrolisis of Vegetable Oil DG Lima, VCD Soares, R Eric B., DA Carvalho, ÉCV Cardoso, FC Rassi, ... | 449 | 2004 |
Definition of a multicenter bond index M Giambiagi, MS de Giambiagi, KC Mundim Structural Chemistry 1, 423-427, 1990 | 275 | 1990 |
Temperature dependence of chemical and biophysical rate processes: Phenomenological approach to deviations from Arrhenius law V Aquilanti, KC Mundim, M Elango, S Kleijn, T Kasai Chemical Physics Letters 498 (1-3), 209-213, 2010 | 188 | 2010 |
Geometry optimization and conformational analysis through generalized simulated annealing KC Mundim, C Tsallis International Journal of Quantum Chemistry 58 (4), 373-381, 1996 | 152 | 1996 |
Stochastic molecular optimization using generalized simulated annealing MA Moret, PG Pascutti, PM Bisch, KC Mundim Journal of computational chemistry 19 (6), 647-657, 1998 | 122 | 1998 |
Uniform description of non-Arrhenius temperature dependence of reaction rates, and a heuristic criterion for quantum tunneling vs classical non-extensive distribution VHC Silva, V Aquilanti, HCB de Oliveira, KC Mundim Chemical Physics Letters 590, 201-207, 2013 | 107 | 2013 |
Multicenter bond index: Grassmann algebra and n-order density functional KC Mundim, M Giambiagi, MS de Giambiagi The Journal of Physical Chemistry 98 (24), 6118-6119, 1994 | 107 | 1994 |
Stereodynamical origin of anti-arrhenius kinetics: negative activation energy and roaming for a four-atom reaction ND Coutinho, VHC Silva, HCB de Oliveira, AJ Camargo, KC Mundim, ... The Journal of Physical Chemistry Letters 6 (9), 1553-1558, 2015 | 78 | 2015 |
Microstructure of Cu–C interface in Cu-based metal matrix composite A Berner, KC Mundim, DE Ellis, S Dorfman, D Fuks, R Evenhaim Sensors and Actuators A: Physical 74 (1-3), 86-90, 1999 | 75 | 1999 |
Temperature coefficient (Q10) and its applications in biological systems: Beyond the Arrhenius theory KC Mundim, S Baraldi, HG Machado, FMC Vieira Ecological Modelling 431, 109127, 2020 | 69 | 2020 |
Exact activation energies and phenomenological description of quantum tunneling for model potential energy surfaces. The F+ H2 reaction at low temperature V Aquilanti, KC Mundim, S Cavalli, D De Fazio, A Aguilar, JM Lucas Chemical Physics 398, 186-191, 2012 | 64 | 2012 |
Snapshot of an electron orbital S Dorfman, KC Mundim, D Fuks, A Berner, DE Ellis, J Van Humbeeck Mater. Sci. Eng 15 (191), 00308-3, 2001 | 62 | 2001 |
New stochastic strategy to analyze helix folding MA Moret, PM Bisch, KC Mundim, PG Pascutti Biophysical journal 82 (3), 1123-1132, 2002 | 58 | 2002 |
Deformed transition‐state theory: Deviation from A rrhenius behavior and application to bimolecular hydrogen transfer reaction rates in the tunneling regime VH Carvalho‐Silva, V Aquilanti, HCB de Oliveira, KC Mundim Journal of computational chemistry 38 (3), 178-188, 2017 | 56 | 2017 |
Modeling diatomic potential energy curves through the generalized exponential function CS Esteves, HCB De Oliveira, L Ribeiro, R Gargano, KC Mundim Chemical Physics Letters 427 (1-3), 10-13, 2006 | 54 | 2006 |
Molecular dynamics simulations of signal sequences at a membrane/water interface EPG Areas, PG Pascutti, S Schreier, KC Mundim, PM Bisch The Journal of Physical Chemistry 99 (40), 14885-14892, 1995 | 47 | 1995 |
Theoretical reaction kinetics astride the transition between moderate and deep tunneling regimes: the F+ HD case S Cavalli, V Aquilanti, KC Mundim, D De Fazio The Journal of Physical Chemistry A 118 (33), 6632-6641, 2014 | 45 | 2014 |
GSA algorithm applied to electronic structure: Hartree–Fock–GSA method MD De Andrade, KC Mundim, LAC Malbouisson International journal of quantum chemistry 103 (5), 493-499, 2005 | 45 | 2005 |
Formation of nano-crystalline structure at the interface in Cu–C composite A Berner, D Fuks, DE Ellis, K Mundim, S Dorfman Applied surface science 144, 677-681, 1999 | 44 | 1999 |
Optimization of non-linear gravity models through generalized simulated annealing KC Mundim, TJ Lemaire, A Bassrei Physica A: Statistical Mechanics and its Applications 252 (3-4), 405-416, 1998 | 44 | 1998 |