Electronic Structure: Theory and Spectra I

Presentations

• First-principles interpretation of attosecond time-resolved XUV absorption spectroscopy of laser excited Silicon

  ORAL

  March 2, 2015, 8:00 AM – March 2, 2015, 8:12 AM

  Authors

  • Sri Chaitanya Das Pemmaraju

    • Lawrence Berkeley Natl Lab

  • Shunsuke Sato

    • University of Tsukuba

  • Kazuhiro Yabana

    • University of Tsukuba

  • Krupa Ramasesha

    • University of California, Berkeley

  • Martin Schultze

    • Ludwig-Maximilians-Universitat

  • Stephen R. Leone

    • University of California, Berkeley

  • David Prendergast

    • Lawrence Berkeley National Lab
    • Joint Center for Energy Storage Research, The Molecular Foundry, Lawrence Berkeley National Laboratory
    • Lawrence Berkeley National Laboratory (LBNL)
    • Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, United States
    • Lawrence Berkeley Natl Lab

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• First-principles calculation of electronic structure and optical absorption of BN ZnO

  ORAL

  March 2, 2015, 8:12 AM – March 2, 2015, 8:24 AM

  Authors

  • Xiao Zhang

    • Univ of Illinois - Urbana

  • Andre Schleife

    • Univ of Illinois - Urbana
    • University of Illinois at Urbana-Champaign
    • University of Illinois-Urbana

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• Wannier function analysis of charge states in transition metal oxides

  ORAL

  March 2, 2015, 8:24 AM – March 2, 2015, 8:36 AM

  Authors

  • Yundi Quan

    • Univ of California - Davis

  • Warren Pickett

    • University of California, Davis
    • University of California Davis
    • Univ of California - Davis

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• DFT+\textit{U} invstigation of doped-PbPdO$_2$ spin gapless semiconductors

  ORAL

  March 2, 2015, 8:36 AM – March 2, 2015, 8:48 AM

  Authors

  • Han Hsu

    • National Central University

  • Sheng-Chieh Huang

    • National Central University

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• Final-state effect on X-ray photoelectron spectrum of n-doped SrTiO$_3$

  ORAL

  March 2, 2015, 8:48 AM – March 2, 2015, 9:00 AM

  Authors

  • Chungwei Lin

    • UT Austin, Physics Department

  • Agham Posadas

    • UT Austin, Physics Department

  • Alexander Demkov

    • UT Austin, Physics Department

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• Test set for materials science and engineering

  ORAL

  March 2, 2015, 9:00 AM – March 2, 2015, 9:12 AM

  Authors

  • Toktam Morshedloo

    • Fritz-Haber-Institut der MPG, Berlin, DE; Ferdowsi University of Mashhad, IR

  • Norina A. Richter

    • Fritz-Haber-Institut der MPG, Berlin, DE

  • Fawzi Mohamed

    • Fritz-Haber-Institut der MPG, Berlin, DE

  • Xinguo Ren

    • Fritz-Haber-Institut der MPG, Berlin, DE; University of Science and Technology of China, China

  • Sergey V. Levchenko

    • Fritz-Haber-Institut der MPG, Berlin
    • Fritz-Haber-Institut der MPG, Berlin, DE

  • Luca M. Ghiringhelli

    • Fritz-Haber-Institut der MPG, Berlin, DE
    • Fritz-Haber-Institut der MPG, Berlin

  • Igor Ying Zhang

    • Fritz-Haber-Institut der MPG, Berlin, DE

  • Matthias Scheffler

    • Fritz-Haber-Institut der MPG, Berlin
    • Fritz-Haber-Institut der MPG, Berlin, DE
    • Fritz Haber Institute of the MPG, Berlin, DE
    • Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin, DE

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• Accurate Electronic, Transport, and Structural Properties of Disodium Sulfide (Na$_{2}$S)

  ORAL

  March 2, 2015, 9:12 AM – March 2, 2015, 9:24 AM

  Authors

  • Walter Lynn

    • Carleton College, Northfield, MN

  • Bethuel Khamala

    • Southern Univ \& A\&M College

  • Yuriy Malozovsky

    • Southern University and A\&M College
    • Southern Univ \& A\&M College

  • Diola Bagayoko

    • Southern Univ \& A\&M Coll
    • Southern University and A\&M College
    • Southern Univ \& A\&M College

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• Electronic structure, spin--orbit coupling, and interlayer interaction in bulk MoS$_2$ and WS$_2$

  ORAL

  March 2, 2015, 9:24 AM – March 2, 2015, 9:36 AM

  Authors

  • Drew Latzke

    • University of California, Berkeley and Lawrence Berkeley National Laboratory

  • Wentao Zhang

    • University of California, Berkeley and Lawrence Berkeley National Laboratory

  • Sefaattin Tongay

    • Arizona State University

  • Tay-Rong Chang

    • National Tsing Hua University

  • Hsin Lin

    • National University of Singapore

  • Horng-Tay Jeng

    • National Tsing Hua University and Academia Sinica

  • Aslihan Suslu

    • Arizona State University

  • Junqiao Wu

    • University of California, Berkeley and Lawrence Berkeley National Laboratory

  • Arun Bansil

    • Northeastern University

  • Alessandra Lanzara

    • University California, Berkeley and Materials Sciences Division, Lawrence Berkeley National Laboratory
    • Materials Sciences Division, Lawrence Berkeley National Laboratory / Department of Physics, UC Berkeley
    • University of California, Berkeley and Lawrence Berkeley National Laboratory

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• Barium disilicides (BaSi$_{2})$ a low-cost, earth-abundant material for thin-film solar cells

  ORAL

  March 2, 2015, 9:36 AM – March 2, 2015, 9:48 AM

  Authors

  • Mukesh Kumar

    • Natl Inst for Materials Sci

  • Naoto Umezawa

    • Natl Inst for Materials Sci

  • Motoharu Imai

    • Natl Inst for Materials Sci

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• Quantifying defect levels in hexagonal boron nitride from simulated x-ray absorption spectroscopy

  ORAL

  March 2, 2015, 9:48 AM – March 2, 2015, 10:00 AM

  Authors

  • Sebastiaan Huber

    • Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, United States

  • Robbert van de Kruijs

    • Industrial Focus Group XUV Optics, MESA+ Research Institute for Nanotechnology, University of Twente, The Netherlands

  • Fred Bijkerk

    • Industrial Focus Group XUV Optics, MESA+ Research Institute for Nanotechnology, University of Twente, The Netherlands

  • Eric Gullikson

    • Center for X-Ray Optics, Lawrence Berkeley National Laboratory, Berkeley, United States

  • David Prendergast

    • Lawrence Berkeley National Lab
    • Joint Center for Energy Storage Research, The Molecular Foundry, Lawrence Berkeley National Laboratory
    • Lawrence Berkeley National Laboratory (LBNL)
    • Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, United States
    • Lawrence Berkeley Natl Lab

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• Accurate, Electronic and Transport Properties of Wurtzite Aluminum Nitride (w-AlN)

  ORAL

  March 2, 2015, 10:00 AM – March 2, 2015, 10:12 AM

  Authors

  • Ifeanyi Nwigboji

    • Southern University and A\&M College

  • Yuriy Malozovsky

    • Southern University and A\&M College
    • Southern Univ \& A\&M College

  • Lashounda Franklin

    • Southern Univ \& A\&M Coll
    • Southern University and A\&M College

  • Chinedu Ekuma

    • Louisiana State University
    • Louisiana State Univ - Baton Rouge
    • Louisiana State University and A\&M College

  • Diola Bagayoko

    • Southern Univ \& A\&M Coll
    • Southern University and A\&M College
    • Southern Univ \& A\&M College

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• Electronic properties of perovskite absorbers for solar cell applications

  ORAL

  March 2, 2015, 10:12 AM – March 2, 2015, 10:24 AM

  Authors

  • Marina Filip

    • Department of Materials, University of Oxford, Parks Road, Oxford, OX1 3PH, UK
    • University of Oxford, Department of Materials

  • Feliciano Giustino

    • Department of Materials, University of Oxford, Parks Road, Oxford, OX1 3PH, UK
    • University of Oxford, Department of Materials

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• Chemical trends in halide perovskite electronic properties

  ORAL

  March 2, 2015, 10:24 AM – March 2, 2015, 10:36 AM

  Authors

  • Walter Lambrecht

    • Case Western Reserve University

  • Ling-yi Huang

    • Case Western Reserve University

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• Electronic structure studies of MX$_{2} $(M$=$Mo, W; X$=$S, Se) by ARPES and the band evolution of hydrogen gas exposed MoS$_{2}$

  ORAL

  March 2, 2015, 10:36 AM – March 2, 2015, 10:48 AM

  Authors

  • Beom Seo Kim

    • Yonsei Univ

  • Soohyun Cho

    • Yonsei Univ

  • Beomyoung Kim

    • Yonsei Univ

  • Jonathan Denlinger

    • Advanced Light Source

  • Byung Hoon Kim

    • Incheon National Univ

  • Seung Ryong Park

    • Incheon National Univ

  • Changyoung Kim

    • Yonsei Univ

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• Discrete energy bands in bulk semiconductors

  ORAL

  March 2, 2015, 10:48 AM – March 2, 2015, 11:00 AM

  Authors

  • Maohua Du

    • Oak Ridge National Lab

  • Hongliang Shi

    • Oak Ridge National Lab

  View abstract →