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Introduction to “Advanced Electronic Structure Methods in Computational Quantum Chemistry”
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Environmental Chemistry, 3rd Edition
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Dynamical Theory of Crystal Lattices
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A thorough benchmark of density functional methods for general main group thermochemistry, kinetics, and noncovalent interactions
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Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals
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Generalized Gradient Approximation Made Simple
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Density-functional approximation for the correlation energy of the inhomogeneous electron gas
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Conceptual Density Functional Theory and Its Application in the Chemical Domain
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Jacob’s ladder of density functional approximations for the exchange-correlation energy
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First-principles investigation on the stability and material properties of all-inorganic cesium lead iodide perovskites CsPbI3 polymorphs
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已完结