Sökning: "Biplab Sanyal"

Visar resultat 1 - 5 av 16 avhandlingar innehållade orden Biplab Sanyal.

  1. 1. First Principles Studies of Functional Materials Based on Graphene and Organometallics

    Författare :Sumanta Bhandary; Biplab Sanyal; Olle Eriksson; Stefano Sanvito; Uppsala universitet; []
    Nyckelord :NATURAL SCIENCES; NATURVETENSKAP; NATURVETENSKAP; NATURAL SCIENCES; Graphene; Magnetism; Organometallics; Density functional theory; Electron correlation; Spin switching; Nanoribbons; Exchange interaction; Edge functionalization; Band gap; Physics with spec. in Atomic; Molecular and Condensed Matter Physics; Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik;

    Sammanfattning : Graphene is foreseen to be the basis of future electronics owing to its ultra thin structure, extremely high charge carrier mobility,  high thermal conductivity etc., which are expected to overcome the size limitation and heat dissipation problem in silicon based transistors. LÄS MER

  2. 2. The Electronic Structure of Organic Molecular Materials : Theoretical and Spectroscopic Investigations

    Författare :Iulia Emilia Brumboiu; Barbara Brena; Biplab Sanyal; Olle Eriksson; Jakob Schiøtz; Uppsala universitet; []
    Nyckelord :NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURAL SCIENCES; NATURVETENSKAP; NATURVETENSKAP; NATURVETENSKAP; NATURAL SCIENCES; NATURAL SCIENCES; materials theory; electronic structure; photoelectron spectroscopy; near-edge X-ray absorption fine structure; Physics with spec. in Atomic; Molecular and Condensed Matter Physics; Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik; Materialvetenskap; Materials Science;

    Sammanfattning : In the present thesis the electronic properties of two organic molecules were studied by means of density functional theory (DFT) in connection to their possible applications in organic photovoltaics and molecular spintronics respectively.The first analysed system is the C60 derivative PCBM extensively used in polymer solar cells for the charge separation process. LÄS MER

  3. 3. Theoretical Investigations of Two-Dimensional Materials : Studies on Electronic, Magnetic, Mechanical, and Thermal Properties

    Författare :Xin Chen; Biplab Sanyal; Susanne Mirbt; Kristian Sommer Thygsen; Uppsala universitet; []
    Nyckelord :NATURAL SCIENCES; NATURVETENSKAP; NATURVETENSKAP; NATURAL SCIENCES; 2D materials; DFT; Structure search; Functional materials; Physics with spec. in Atomic; Molecular and Condensed Matter Physics; Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik;

    Sammanfattning : Two-dimensional (2D) materials have been paid enormous attention since the first realization of graphene in 2004, in connection to high-speed flexible electronics, 2D magnetism, optoelectronics, and so on. Apart from graphene, many new 2D materials with special properties have been predicted and synthesized. LÄS MER

  4. 4. Magnetization dynamics of complex magnetic materials by atomistic spin dynamics simulations

    Författare :Raghuveer Chimata; Biplab Sanyal; Olle Eriksson; Koopmans Bert; Uppsala universitet; []
    Nyckelord :NATURAL SCIENCES; NATURVETENSKAP; NATURVETENSKAP; NATURAL SCIENCES; Ultrafast remagnetization; ultrafast dynamics; magnetism; multiferroics; amorphous alloys; DFT; spinels magnetostriction; Physics with spec. in Atomic; Molecular and Condensed Matter Physics; Fysik med inriktning mot atom- molekyl- och kondenserande materiens fysik;

    Sammanfattning : In recent years, there has been an intense interest in understanding the microscopic mechanism of laser induced ultrafast magnetization dynamics in picosecond time scales. Magnetization switching on such a time scale has potential to be a significant boost for the data storage industry. LÄS MER

  5. 5. First-principles study of configurational disorder in icosahedral boron-rich solids

    Författare :Annop Ektarawong; Björn Alling; Sergei Simak; Lars Hultman; Biplab Sanyal; Linköpings universitet; []
    Nyckelord :NATURAL SCIENCES; NATURVETENSKAP;

    Sammanfattning : This thesis is a theoretical study of configurationally disordered icosahedral boronrich solids, in particular boron carbides, using density functional theory and alloy theory. The goal is to resolve discrepancies, regarding the properties of boron carbides, between experiments and previous theoretical calculations which have been a controversial issue in the field of icosahedral boron-rich solids. LÄS MER