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Shipra Suneja,Bhanumathi Sharma other molecular properties has undergone rapid growth in recent years. It is now fairly routine for chemists to make use of energy gradient information in locating and identifying stable geometries and transition states. The use of second analytical derivative (Hessian or curvature) expressions is

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David Carré view... It extract long timescale macroscopic/mesoscopic dynamics from microscopic equations in an intuitively understandable way rather than in a mathematically rigorous manner and introduces readers to a mathematically elementary, but useful and widely applicable technique for analyzing asymptoti