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An extension of the grid empowered molecular simulator to quantum reactive scattering.

, , , and . Journal of Computational Chemistry, 33 (6): 708-714 (2012)

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Foreword., and . Future Generation Comp. Syst., 20 (5): 701-702 (2004)An optimized task-farm model to integrate reduced dimensionality Schrödinger equations on distributed memory architectures., , , and . Future Generation Comp. Syst., 15 (4): 497-512 (1999)A full dimensional grid empowered simulation of the CO2 + CO2 processes., , , and . Journal of Computational Chemistry, 33 (22): 1806-1819 (2012)On the Optimization of a Pipeline Model to Integrate a Reduced-Dimensionality Schrödinger Equation for Distributed Memory Architectures., , , and . IJHPCA, 13 (1): 49-62 (1999)A program for performing exact quantum dynamics calculations using cylindrical polar coordinates: A nanotube application., , and . Comput. Phys. Commun., 180 (3): 459-465 (2009)Implementation of the ANSYS® Commercial Suite on the EGI Grid Platform., , , , , , , , , and 1 other author(s). ICCSA (1), volume 7971 of Lecture Notes in Computer Science, page 84-95. Springer, (2013)Thermal Rate Coefficients for the N+N2 Reaction: Quasiclassical, Semiclassical and Quantum Calculations., , , and . ICCSA (1), volume 3480 of Lecture Notes in Computer Science, page 1083-1092. Springer, (2005)Ab Initio and Empirical Atom Bond Formulation of the Interaction of the Dimethylether-Ar System., , , , and . ICCSA (1), volume 3480 of Lecture Notes in Computer Science, page 1046-1053. Springer, (2005)Mobile Device Access to Collaborative Distributed Repositories of Chemistry Learning Objects., , and . ICCSA (1), volume 9786 of Lecture Notes in Computer Science, page 443-454. Springer, (2016)A Grid Empowered Virtual Versus Real Experiment for the Barrierless Li + FH → LiF + H Reaction., and . ICCSA (1), volume 8579 of Lecture Notes in Computer Science, page 571-584. Springer, (2014)