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Fe L-Edge X-ray Absorption Spectra of Fe(II) Polypyridyl Spin Crossover Complexes from Time-Dependent Density Functional Theory

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Two-dimensional stimulated ultraviolet resonance Raman spectra of tyrosine and tryptophan: a simulation study

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Spectral character of intermediate state in solid-state photoarrangement of α-santonin

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First-Principles Study on Core-Level Spectroscopy of Arginine in Gas and Solid Phases

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Gabedit-A graphical user interface for computational chemistry softwares

(2010) Abdul-Rahman Allouche   JOURNAL OF COMPUTATIONAL CHEMISTRY

Time-dependent density functional theory calculations of the spectroscopy of core electrons

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Formation of nascent soot and other condensed-phase materials in flames

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(2008) Andrea D’Anna   PROCEEDINGS OF THE COMBUSTION INSTITUTE

A theoretical and experimental study of the near edge X-ray absorption fine structure (NEXAFS) and X-ray photoelectron spectra (XPS) of nucleobases: Thymine and adenine

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