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Computing Molecular Energy Surfaces on a Grid.

, , and . ICCSA (1), volume 3980 of Lecture Notes in Computer Science, page 675-683. Springer, (2006)

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A program for performing exact quantum dynamics calculations using cylindrical polar coordinates: A nanotube application., , and . Comput. Phys. Commun., 180 (3): 459-465 (2009)On the Optimization of a Pipeline Model to Integrate a Reduced-Dimensionality Schrödinger Equation for Distributed Memory Architectures., , , and . Int. J. High Perform. Comput. Appl., 13 (1): 49-62 (1999)A full dimensional grid empowered simulation of the CO2 + CO2 processes., , , and . J. Comput. Chem., 33 (22): 1806-1819 (2012)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)A Comparison of the Isotope Effect for the N + N2 Reaction Calculated on Two Potential Energy Surfaces., , , and . ICCSA (1), volume 5072 of Lecture Notes in Computer Science, page 1081-1093. Springer, (2008)A Web-Based Metacomputing Problem-Solving Environment for Complex Applications., , and . GRID, volume 1971 of Lecture Notes in Computer Science, page 111-122. Springer, (2000)Quantum Reactive Scattering Calculations on GPU., , and . ICCSA (1), volume 7333 of Lecture Notes in Computer Science, page 292-303. Springer, (2012)A Trial User, Resources and Services Quality Evaluation for Grid Communities Sustainability., and . ICCSA (2), volume 9156 of Lecture Notes in Computer Science, page 324-338. Springer, (2015)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 Circular Economy Proposal on CO _2 Reuse to Produce Methane Using Energy from Renewable Sources., and . ICCSA (5), volume 10964 of Lecture Notes in Computer Science, page 549-562. Springer, (2018)