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100+ datasets found
  1. d

    The Materials Cloud 2D database (MC2D) - Dataset - B2FIND

    • b2find.dkrz.de
    Updated Apr 4, 2023
    + more versions
  2. d

    Materials Cloud three-dimensional crystals database (MC3D) - Dataset -...

    • b2find.dkrz.de
    Updated Apr 27, 2023
    + more versions
  3. m

    Data from: Bias free multiobjective active learning for materials design and...

    • archive.materialscloud.org
    Updated Feb 22, 2021
    + more versions
  4. m

    Automated high-throughput Wannierisation

    • archive.materialscloud.org
    • materialscloud-archive-failover.cineca.it
    Updated Nov 25, 2019
    + more versions
  5. Materials Cloud, An Open Science Portal for FAIR Data Sharing

    • figshare.com
    mp4
    Updated Jun 5, 2023
  6. c

    A new dataset of 415k stable and metastable materials calculated with the...

    • materialscloud-archive-failover.cineca.it
    • archive.materialscloud.org
    Updated May 1, 2023
    + more versions
  7. d

    Construction-materials in Cloud County, Kansas (NGMDB)

    • datadiscoverystudio.org
    • catalog.data.gov
    Updated Jan 1, 1951
  8. c

    Record removed

    • materialscloud-archive-failover.cineca.it
    • archive.materialscloud.org
    Updated Dec 2, 2019
    + more versions
  9. m

    Data from: OSCAR: An extensive repository of chemically and functionally...

    • archive.materialscloud.org
    • materialscloud-archive-failover.cineca.it
    Updated Aug 30, 2022
    + more versions
  10. W

    Data from: MATERIALS FOR IN SITU PROCESSING SYSTEMS

    • cloud.csiss.gmu.edu
    • data.wu.ac.at
    pdf
    Updated Aug 8, 2019
    + more versions
  11. Cloud index fields, cloud motion fields, and supplementary material.

    • zenodo.org
    gif, mp4, tar, txt
    Updated Jul 25, 2024
  12. r

    Atom Probe Workbench version 1.0.0: An Australian cloud-based platform for...

    • researchdata.edu.au
    Updated Jan 22, 2014
  13. m

    Data from: Koopmans spectral functionals: an open-source periodic-boundary...

    • archive.materialscloud.org
    • materialscloud-archive-failover.cineca.it
    Updated Jul 22, 2022
    + more versions
  14. D

    Building Materials Software Market Report | Global Forecast From 2023 To...

    • dataintelo.com
    csv, pdf, pptx
    Updated Apr 15, 2023
  15. W

    Construction materials for coal conversion: performance and properties data

    • cloud.csiss.gmu.edu
    • data.wu.ac.at
    pdf
    Updated Aug 8, 2019
  16. m

    TopoMat: a database of high-throughput first-principles calculations of...

    • archive.materialscloud.org
    • materialscloud-archive-failover.cineca.it
    Updated May 15, 2019
    + more versions
  17. d

    Building a consistent and reproducible database for adsorption evaluation in...

    • b2find.dkrz.de
    Updated Oct 30, 2023
    + more versions
  18. m

    Materials and Chemical Processing Software Market

    • marketresearchintellect.com
    Updated Jan 31, 2024
  19. m

    Materials Management Information System Market

    • marketresearchintellect.com
    Updated Sep 15, 2024
  20. Global ArF Dry and Immersion Resist Materials Market Size By Type, By...

    • verifiedmarketresearch.com
    Updated Jun 10, 2024
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Cite
(2023). The Materials Cloud 2D database (MC2D) - Dataset - B2FIND [Dataset]. https://b2find.dkrz.de/dataset/eacb138d-4f26-5971-a5ad-82a15c5abb36

The Materials Cloud 2D database (MC2D) - Dataset - B2FIND

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Dataset updated
Apr 4, 2023
Description

Two-dimensional (2D) materials are among the most promising candidates for beyond silicon electronic and optoelectronic applications. Recently, their recognized importance, sparked a race to discover and characterize new 2D materials. Within few years the number of experimentally exfoliated or synthesized 2D materials went from a couple of dozens to few hundreds while the number theoretically predicted compounds reached a few thousands. In 2018 we first contributed to this effort with the identification of 1825 compounds that are either easily (1036) or potentially (789) exfoliable from experimentally known 3D compounds. In the present work we report on the new materials recently added to the 2D-portfolio thanks to the extension of the screening to an additional experimental database (MPDS) as well as the most up-to-date versions of the two databases (ICSD and COD) used in our previous work. This expansion led to the discovery of an additional 1252 unique monolayers bringing the total to 3077 compounds and, notably, almost doubling the number of easily exfoliable materials (2004). Moreover, we optimized the structural properties of all the materials (regardless of their binding energy or number of atoms in the unit cell) as isolated mono-layer and explored their electronic band structure. This archive entry contains the database of 2D materials in particular it contains the structural parameters for all the 3077 structures of the global Material Cloud 2D database as extracted from their bulk 3D parent, 2710 optimized 2D structures and 2345 electronic band structure together with the provenance of all data and calculations as stored by AiiDA.

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