Concepedia

COMPCHEM: Progress Towards GEMS a Grid Empowered Molecular Simulator and Beyond

Antonio Laganà, Alessandro Costantini, Osvaldo Gervasi, Noelia Faginas‐Lago, Carlo Manuali, Sergio Rampino

Journal of Grid Computing · 2010 · 62 citations · 28 references

DOI

Concepts

References

28

Theory of chemical reaction dynamics

Marcel D. Baer · Medical Entomology and Zoology · 1985 · 1.3K citations

, , +12

Space-fixed vs body-fixed axes in atom-diatomic molecule scattering. Sudden approximations

Russell T Pack · The Journal of Chemical Physics · 1974 · 1.1K citations

, , +17

Quantum mechanical close coupling approach to molecular collisions. <i>jz</i> -conserving coupled states approximation

Paul McGuire, Donald J. Kouri · The Journal of Chemical Physics · 1974 · 1K citations

, , +15

An improved log derivative method for inelastic scattering

David E. Manolopoulos · The Journal of Chemical Physics · 1986 · 706 citations

, , +11

Quantum reactive scattering in three dimensions using hyperspherical (APH) coordinates. Theory

Russell T Pack, Gregory A. Parker · The Journal of Chemical Physics · 1987 · 603 citations

, , +13