Collection
9th Congress on Electronic Structure: Principles and Applications (ESPA 2014)
9th Congress on Electronic Structure: Principles and Applications (ESPA 2014)
Articles (25 in this collection)
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Effect of van der Waals interactions in the DFT description of self-assembled monolayers of thiols on gold
Authors (first, second and last of 4)
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Revisiting the mechanism and the influence of the excitation wavelength on the surface-enhanced Raman scattering of the pyridine–Ag20 system
Authors (first, second and last of 4)
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Invariant time-dependent exchange perturbation theory and its application to the particles collision problem
Authors (first, second and last of 4)
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Scavenger mechanism of methylglyoxal by metformin. A DFT study
Authors (first, second and last of 4)
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Separating nuclear spin isomers using a pump–dump laser scheme
Authors (first, second and last of 4)
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Structural relaxation effects on the lowest \(4f{-}5d\) transition of \(\hbox {Ce}^{3+}\) in garnets
Authors
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Spin delocalization in hydrogen chains described with the spin-partitioned total position-spread tensor
Authors (first, second and last of 7)
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Is the structure of hydroxide dihydrate OH−(H2O)2? An ab initio path integral molecular dynamics study
Authors (first, second and last of 4)
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A local topological view of pressure-induced polymorphs in SiO2
Authors (first, second and last of 6)
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