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B 79 , Information content in o[1s] k-edge x-ray emission spectroscopy of liquid water. A , — Weinhardt, L. Nuclear dynamics and spectator effects in resonant inelastic soft x-ray scattering of gas-phase water molecules. Pietzsch, A. Snapshots of the fluctuating hydrogen bond network in liquid water on the sub-femtosecond timescale with vibrational resonant inelastic x-ray scattering.

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Ultrafast dissociation features in rixs spectra of the water molecule. Eckert, S. One-dimensional cuts through multidimensional potential-energy surfaces by tunable x rays.


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Smith, J. Energetics of hydrogen bond network rearrangements in liquid water. Probing the local structure of liquid water by X-ray absorption spectroscopy. B , — Santra, B. Local structure analysis in ab initio liquid water. Wernet, Ph. The structure of the first coordination shell in liquid water. Chen, W. X-ray absorption signatures of the molecular environment in water and ice. Electronic signature of the instantaneous asymmetry in the first coordination shell of liquid water. Nyberg, M. Core-hole effects in x-ray-absorption spectra of fullerenes.

B 60 , Sun, Y. Intramolecular soft modes and intermolecular interactions in liquid acetone.

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B 84 , Ghiringhelli, G. Saxes, a high resolution spectrometer for resonant x-ray emission in the — ev energy range. Bertie, J. Infrared intensities of liquids xx: The intensity of the oh stretching band of liquid water revisited, and the best current values of the optical constants of h2o l at 25 c between 15, and 1 cm- 1. The effects of dissolved halide anions on hydrogen bonding in liquid water. Costard, R. Ramasesha, K.

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Water vibrations have strongly mixed intra- and intermolecular character. Myneni, S. Spectroscopic probing of local hydrogen-bonding structures in liquid water. Matter 14 , L—L Prendergast, D. X-ray absorption spectra of water from first principles calculations. Sun, Z. X-ray absorption of liquid water by advanced ab initio methods. B 96 , Iannuzzi, M. Inner-shell spectroscopy by the gaussian and augmented plane wave method. Fortin, F. DEAP: Evolutionary algorithms made easy.


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Resonant X-ray Raman scattering. Strocov, V.


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    Spectroscopic Investigations of Hydrogen Bond Network Structures in Water Clusters

    Becke, A. Density-functional exchange-energy approximation with correct asymptotic behavior. Lee, C. Development of the colle-salvetti correlation-energy formula into a functional of the electron density. B 37 , — Version 2. Hutter, J.

    Covalent Bonds, Hydrogen Bonds - MIT 7.01SC Fundamentals of Biology

    Wiley Interdiscip. Weigend, F. Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: design and assessment of accuracy. Hydrogen bonding and raman, ir, and 2d-ir spectroscopy of dilute hod in liquid d2o. USA , — Kumar, R. Hydrogen bonding definitions and dynamics in liquid water. Henchman, R. Matter 28 , Shiratani, E.