Search for dissertations about: "Antonio Rizzo"

Found 4 swedish dissertations containing the words Antonio Rizzo.

  1. 1. Theoretical Studies on Vibrationally Resolved Optical Spectra of Polycyclic Aromatic Molecules

    Author : Junfeng Li; Yi Luo; Antonio Rizzo; KTH; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Theoretical study; optical spectra; vibronic effect; polycyclic aromatic molecules; Theoretical Chemistry and Biology; Teoretisk kemi och biologi;

    Abstract : Polycyclic aromatic molecules are of great interest owing to their many important applications in chemistry and have therefore been the focus of investigations for over half a century with spectroscopic techniques. This thesis is devoted to the modeling of vibrationally resolved optical spectra of polycyclic aromatic molecules. READ MORE

  2. 2. Density Functional Response Theory with Applications to Electron and Nuclear Magnetic Resonance

    Author : Corneliu I. Oprea; Olav Vahtras; Antonio Rizzo; KTH; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; biochemistry; molecular physics; computer science; Theoretical chemistry; Teoretisk kemi;

    Abstract : This thesis presents quantum chemical calculations, applications of the response function formalism recently implemented within the framework of density functional theory by our research group. The purpose of the calculations is to assess the performance of this perturbative approach to determining heavy atom effects on magnetic resonance parameters. READ MORE

  3. 3. Charge-transfer excitations and phtophysical properties of molecular building blocks

    Author : Oscar Rubio Pons; Yi Luo; Antonio Rizzo; KTH; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Theoretical chemistry; Photophysical porperties; CCSD; CASSCF; Teoretisk kemi; Theoretical chemistry; Teoretisk kemi;

    Abstract : This thesis reports a state-of-the-art theoretical study of photophysical properties of organic charge-transfer aromatic molecules. These molecules are building blocks of molecular functional materials used in modern photonics technology and play essential roles in chemistry and biology in general. READ MORE

  4. 4. On the Relative Utility of 3D Interfaces

    Author : Monica Tavanti; Mats Lind; Antonio Rizzo; Uppsala universitet; []
    Keywords : NATURVETENSKAP; NATURAL SCIENCES; Människa-dator-interaktion; human-computer interaction; information visualization; 2D and 3D interfaces; Människa-dator-interaktion; Information technology; Informationsteknologi; datavetenskap med inriktning människa-dator interaktion; Computer Science; human-computer interaction;

    Abstract : Three-dimensional (3D) interfaces are made with the ambition to reinvent traditional two-dimensional (2D) displays into intuitive 3D environments that allow natural interactions and guarantee users’ satisfaction. However, reality is far from the expectations and 3D interfaces remain experimental. READ MORE