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Showing 1 to 3 of 3 for “"Low-Frequency Vibrational Spectroscopy"”.

  1. CHARACTERIZATION OF CRYSTALLINE PIGMENTS WITH LOW-FREQUENCY VIBRATIONAL SPECTROSCOPY AND SOLID-STATE DENSITY FUNCTIONAL THEORY

    … broader availability of terahertz time-domain spectroscopy (THz-TDS) and low-frequency Raman spectroscopy (LFRS). In this work, the capabilities of THz-TDS and LFRS for identification and characterization of historic and modern pigments were evaluated. These experimental studies were supported …

    syracuse-diss Repository record for CHARACTERIZATION OF CRYSTALLINE PIGMENTS WITH LOW-FREQUENCY VIBRATIONAL SPECTROSCOPY AND SOLID-STATE DENSITY FUNCTIONAL THEORY (opens in a new tab)

  2. Evaluation of the Energetic Factors in Crystalline Pharmaceuticals Using Solid-state Density Functional Theory and Low-frequency Vibrational Spectroscopy

    … hydrates, and cocrystals. In this work, low-frequency vibrational spectroscopies and rigorous quantum mechanical simulations are combined to provide a new technique for characterizing and investigating pharmaceutically relevant polymorphs, hydrates, and cocrystals as well as a series of …

    syracuse-diss Repository record for Evaluation of the Energetic Factors in Crystalline Pharmaceuticals Using Solid-state Density Functional Theory and Low-frequency Vibrational Spectroscopy (opens in a new tab)

  3. Investigating the Properties and Lattice Vibrations of Ordered and Disordered Crystalline Materials

    … understood. In this thesis the techniques of low-frequency vibrational spectroscopy by means of terahertz time-domain spectroscopy (THz-TDS) were combined with density functional theory (DFT) simulations to investigate the role and effect of disorder for small organic molecular materials …

    cambridge Repository record for Investigating the Properties and Lattice Vibrations of Ordered and Disordered Crystalline Materials (opens in a new tab)