Extension of the Lennard-Jones potential: Theoretical investigations into rare-gas clusters and crystal lattices of He, Ne, Ar, and Kr using many-body interaction expansions P Schwerdtfeger, N Gaston, RP Krawczyk, R Tonner, GE Moyano
Physical Review B 73 (6), 064112, 2006
155 2006 The potential energy curve and dipole polarizability tensor of mercury dimer P Schwerdtfeger, R Wesendrup, GE Moyano, AJ Sadlej, J Greif, F Hensel
The Journal of Chemical Physics 115 (16), 7401-7412, 2001
102 2001 Properties of Small- to Medium-Sized Mercury Clusters from a Combined ab initio , Density-Functional, and Simulated-Annealing Study GE Moyano, R Wesendrup, T Söhnel, P Schwerdtfeger
Physical review letters 89 (10), 103401, 2002
64 2002 Interpolated potential energy surface and classical dynamics for and GE Moyano, MA Collins
The Journal of chemical physics 119 (11), 5510-5517, 2003
45 2003 Towards J/mol accuracy for the cohesive energy of solid argon P Schwerdtfeger, R Tonner, GE Moyano, E Pahl
Angewandte Chemie International Edition 55 (40), 12200-12205, 2016
44 2016 Interpolated potential energy surface for abstraction and exchange reactions of NH 3 + H and deuterated analogues GE Moyano, MA Collins
Theoretical Chemistry Accounts 113, 225-232, 2005
42 2005 Lattice dynamics for fcc rare gas solids Ne, Ar, and Kr from ab initio potentials GE Moyano, P Schwerdtfeger, K Rosciszewski
Physical Review B 75 (2), 024101, 2007
41 2007 Molecular potential energy surfaces by interpolation: Strategies for faster convergence GE Moyano, MA Collins
The Journal of chemical physics 121 (20), 9769-9775, 2004
28 2004 An atomistic fourth-order virial equation of state for argon from first principles calculations J Wiebke, P Schwerdtfeger, GE Moyano, E Pahl
Chemical Physics Letters 514 (1-3), 164-167, 2011
25 2011 Interpolated potential energy surfaces and dynamics for atom exchange between H and and D and GE Moyano, D Pearson, MA Collins
The Journal of chemical physics 121 (24), 12396-12401, 2004
24 2004 Ab initio interpolated potential energy surface and classical reaction dynamics for HCO++ H, HOC++ H, and deuterated analogues GE Moyano, SA Jones, MA Collins
The Journal of chemical physics 124 (12), 2006
16 2006 Erratum:“The potential energy curve and dipole polarizability tensor of mercury dimer”[J. Chem. Phys. 115, 7401(2001)] P Schwerdtfeger, R Wesendrup, GE Moyano, AJ Sadlej, J Greif, F Hensel
The Journal of Chemical Physics 117 (14), 6881, 2002
6 2002 Melting of Lennard-Jones rare-gas clusters doped with a single impurity atom N Quesada, GE Moyano
Physical Review B 82 (5), 054104, 2010
5 2010 Hochgenaue Berechnung der Kohäsionsenergie von festem Argon mit Abweichungen im J/mol‐Bereich P Schwerdtfeger, R Tonner, GE Moyano, E Pahl
Angewandte Chemie 128 (40), 12387-12392, 2016
3 2016 OCS isomerization and dissociation kinetics from statistical models GA Lara-Cruz, GE Moyano
Theoretical Chemistry Accounts 137 (6), 79, 2018
2 2018 Simulación de nanomateriales mediante métodos tipo monte carlo GE Moyano, N Quesada
FORMACIÓN Y MODELACIÓN EN CIENCIAS BÁSICAS, 294, 2012
2012 Programas para la simulación numérica de nanoagregados. Cálculo de propiedades termodinámicas en plataforma distribuidas N Quesada, GE Moyano
Universidad de Antioquia, 2011
2011 Structure, structural phase transitions, mechanical properties, defects-Lattice dynamics for fcc rare gas solids Ne, Ar, and Kr from ab initio potentials GE Moyano, P Schwerdtfeger, K Rosciszewski
Physical Review B Condensed Matter And Materials Physics 75 (2), 24101, 2007
2007 Molecular potential energy surfaces. MA Collins, GE Moyano, CR Evenhuis, V Deev
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 229, U773-U773, 2005
2005 Interpolated Potential Energy Surfaces for Theoretical Studies on the Dynamics of Interstellar Reactions GE Moyano, MA Collins
Astrochemistry: Recent Successes and Current Challenges 231, 41, 2005
2005