| i-TTM model for ab initio-based ion–water interaction potentials. 1. Halide–water potential energy functions DJ Arismendi-Arrieta, M Riera, P Bajaj, R Prosmiti, F Paesani The Journal of Physical Chemistry B 120 (8), 1822-1832, 2016 | 84 | 2016 |
| A new accurate and full dimensional potential energy surface of H5+ based on a triatomics-in-molecules analytic functional form A Aguado, P Barragán, R Prosmiti, G Delgado-Barrio, P Villarreal, ... The Journal of chemical physics 133 (2), 2010 | 81 | 2010 |
| Determining the bulk viscosity of rigid water models GS Fanourgakis, JS Medina, R Prosmiti The Journal of Physical Chemistry A 116 (10), 2564-2570, 2012 | 77 | 2012 |
| An accurate, global, ab initio potential energy surface for the H+ 3 molecule OL Polyansky, R Prosmiti, W Klopper, J Tennyson Molecular Physics 98 (5), 261-273, 2000 | 71 | 2000 |
| Molecular dynamics simulations of rigid and flexible water models: Temperature dependence of viscosity JS Medina, R Prosmiti, P Villarreal, G Delgado-Barrio, G Winter, ... Chemical Physics 388 (1-3), 9-18, 2011 | 69 | 2011 |
| Ab initio ground state potential energy surfaces for complexes R Prosmiti, C Cunha, P Villarreal, G Delgado-Barrio The Journal of chemical physics 116 (21), 9249-9254, 2002 | 66 | 2002 |
| A global potential energy surface for the H3+ molecule R Prosmiti, OL Polyansky, J Tennyson Chemical physics letters 273 (3-4), 107-114, 1997 | 63 | 1997 |
| The van der Waals potential energy surfaces and structures of He–ICl and Ne–ICl clusters R Prosmiti, C Cunha, P Villarreal, G Delgado-Barrio The Journal of chemical physics 117 (15), 7017-7023, 2002 | 60 | 2002 |
| An ab initio CCSD (T) potential energy surface for the Ar–I2 (X) complex R Prosmiti, P Villarreal, G Delgado-Barrio Chemical physics letters 359 (5-6), 473-479, 2002 | 60 | 2002 |
| Structures and Energetics of Clusters (n= 5− 11) R Prosmiti, P Villarreal, G Delgado-Barrio The Journal of Physical Chemistry A 107 (23), 4768-4772, 2003 | 54 | 2003 |
| Modeling the H5+ potential-energy surface: a first attempt R Prosmiti, AA Buchachenko, P Villarreal, G Delgado-Barrio Theoretical Chemistry Accounts 106, 426-433, 2001 | 54 | 2001 |
| Periodic orbits, bifurcation diagrams and the spectroscopy of C2H2 system R Prosmiti, SC Farantos The Journal of chemical physics 103, 3299, 1995 | 53 | 1995 |
| Thermodynamics of water dimer dissociation in the primary hydration shell of the iodide ion with temperature-dependent vibrational predissociation spectroscopy CT Wolke, FS Menges, N Tötsch, O Gorlova, JA Fournier, GH Weddle, ... The Journal of Physical Chemistry A 119 (10), 1859-1866, 2015 | 49 | 2015 |
| HeBr2 complex: ground-state potential and vibrational dynamics from ab initio calculations Á Valdés*, R Prosmiti, P Villarreal, G Delgado-Barrio Molecular Physics 102 (21-22), 2277-2283, 2004 | 48 | 2004 |
| Ab initio calculations, potential representation and vibrational dynamics of He2Br2 van der Waals complex A Valdés, R Prosmiti, P Villarreal, G Delgado-Barrio The Journal of chemical physics 122 (4), 2005 | 46 | 2005 |
| He79Br2 B, v= 8← X, v ″= 0 excitation spectrum: Ab initio prediction and spectroscopic manifestation of a linear isomer AA Buchachenko, R Prosmiti, C Cunha, G Delgado-Barrio, P Villarreal The Journal of chemical physics 117 (13), 6117-6120, 2002 | 45 | 2002 |
| Polar di-halogen molecules solvated in bosonic helium clusters: The paradigm of MP de Lara-Castells, R Prosmiti, G Delgado-Barrio, D López-Durán, ... Physical Review A—Atomic, Molecular, and Optical Physics 74 (5), 053201, 2006 | 44 | 2006 |
| A theoretical study of He2ICl van der Waals cluster Á Valdés, R Prosmiti, P Villarreal, G Delgado-Barrio The Journal of chemical physics 125 (1), 2006 | 43 | 2006 |
| Three-dimensional ab initio potential and ground state dynamics of the HeI2 complex R Prosmiti, Á Valdés, P Villarreal, G Delgado-Barrio The Journal of Physical Chemistry A 108 (28), 6065-6071, 2004 | 42 | 2004 |
| AUTO_DERIV: Tool for automatic differentiation of a FORTRAN code S Stamatiadis, R Prosmiti, SC Farantos Computer Physics Communications 127 (2-3), 343-355, 2000 | 42 | 2000 |
Álvaro Valdés de LuxánUniversidad Nacional de Colombia在 unal.edu.co 的电子邮件经过验证
