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Sidney YipThe most comprehensive reference on materials modelling and simulation across length and time scales.Definitive collection of articles on electronic-structure and atomistic methods for graduate studenInterregnum 发表于 2025-3-22 14:31:38
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Achieving Predictive Simulations with Quantum Mechanical Forces Via the Transfer Hamiltonian: ProbleAccording to the Westmoreland report [.], “in the next ten years, molecularly based modeling will profoundly affect how new chemistry, biology, and materials physics are understood, communicated, and transformed to technology, both intellectually and in commercial applications. It creates new ways of thinking — and of achieving.”