Journal Article FZJ-2017-06568

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Two-dimensional topological nodal line semimetal in layered X 2 Y ( X = Ca , Sr, and Ba; Y = As , Sb, and Bi)

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2017
Inst. Woodbury, NY

Physical review / B 95(23), 235138 () [10.1103/PhysRevB.95.235138]

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Abstract: In topological semimetals the Dirac points can form zero-dimensional and one-dimensional manifolds, as predicted for Dirac/Weyl semimetals and topological nodal line semimetals, respectively. Here, based on first-principles calculations, we predict a topological nodal line semimetal phase in the two-dimensional compounds X2Y (X = Ca, Sr, and Ba; Y = As, Sb, and Bi) in the absence of spin-orbit coupling (SOC) with a band inversion at the M point. A nontrivial Z2 invariant of Z2=1 remains although a tiny gap appears at the nodal line when SOC is included. The mirror symmetry as well as the electrostatic interaction, which can be engineered via strain, are responsible for the nontrivial phase. In addition, the nontrivial phase is further explicitly confirmed via the existence of exotic edge states without and with SOC.

Classification:

Contributing Institute(s):
  1. Quanten-Theorie der Materialien (IAS-1)
  2. Quanten-Theorie der Materialien (PGI-1)
  3. JARA-FIT (JARA-FIT)
  4. JARA - HPC (JARA-HPC)
Research Program(s):
  1. 522 - Controlling Spin-Based Phenomena (POF3-522) (POF3-522)
  2. 142 - Controlling Spin-Based Phenomena (POF3-142) (POF3-142)
  3. 143 - Controlling Configuration-Based Phenomena (POF3-143) (POF3-143)
  4. Magnetic Anisotropy of Metallic Layered Systems and Nanostructures (jiff13_20131101) (jiff13_20131101)
  5. Topological transport in real materials from ab initio (jias12_20121101) (jias12_20121101)

Appears in the scientific report 2017
Database coverage:
Medline ; American Physical Society Transfer of Copyright Agreement ; OpenAccess ; Current Contents - Physical, Chemical and Earth Sciences ; Ebsco Academic Search ; IF < 5 ; JCR ; SCOPUS ; Science Citation Index ; Science Citation Index Expanded ; Thomson Reuters Master Journal List ; Web of Science Core Collection
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Dokumenttypen > Aufsätze > Zeitschriftenaufsätze
JARA > JARA > JARA-JARA\-FIT
JARA > JARA > JARA-JARA\-HPC
Institutssammlungen > IAS > IAS-1
Institutssammlungen > PGI > PGI-1
Workflowsammlungen > Öffentliche Einträge
Publikationsdatenbank
Open Access

 Datensatz erzeugt am 2017-09-14, letzte Änderung am 2023-04-26


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