DOI: 10.1016/j.jallcom.2017.03.121. Competing rhombohedral and monoclinic crystal structures in <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si1.gif" overflow="scroll"><mml:mrow><mml:msub><mml:mrow><mml:mtext>MnPn</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mtext>Ch</mml:mtext></mml:mrow><mml:mn>4</mml:mn></mml:msub></mml:mrow></mml:math> compounds: An ab-initio study

Competing rhombohedral and monoclinic crystal structures in MnPn2Ch4 compounds: An ab-initio study

10.1016/j.jallcom.2017.03.121

Crossref journal-article

Elsevier BV

Journal of Alloys and Compounds (78)

Bibliography

Eremeev, S. V., Otrokov, M. M., & Chulkov, E. V. (2017). Competing rhombohedral and monoclinic crystal structures in MnPn2Ch4 compounds: An ab-initio study. Journal of Alloys and Compounds, 709, 172â178.

Authors 3

S.V. Eremeev (first)
M.M. Otrokov (additional)
E.V. Chulkov (additional)

References 25 Referenced 66

{'key': '10.1016/j.jallcom.2017.03.121_bib1', 'first-page': '31', 'article-title': 'Roentgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierite, FeSb2S4', 'volume': '186', 'author': 'Bente', 'year': '1989', 'journal-title': 'Z.\xa0Krist.'} / Z. Krist. / Roentgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierite, FeSb2S4 by Bente (1989)
{'key': '10.1016/j.jallcom.2017.03.121_bib2', 'first-page': '226', 'article-title': 'The crystal structure of berthierite, FeSb2S4', 'volume': '40', 'author': 'Buerger', 'year': '1955', 'journal-title': 'Am. Mineralogist'} / Am. Mineralogist / The crystal structure of berthierite, FeSb2S4 by Buerger (1955)
10.1002/anie.201005458 / Angew. Chem. Int. Ed. / Structural-distortion-driven cooperative magnetic and semiconductor-to-insulator transitions in ferromagnetic FeSb2Se4 by Djieutedjeu (2010)
10.1007/s00269-007-0213-3 / Phys. Chem. Minerals / Magnetic properties and neutron diffraction study of two manganese sulfosalts: monoclinic MnSb2S4 and benavidesite (MnPb4Sb6S14) by Léone (2008)
10.1103/PhysRevB.71.235207 / Phys. Rev. B / Electronic structure of the antiferromagnetic semiconductor MnSb2S4 by Matar (2005)
10.1021/ic101351b / Inorg. Chem. / Analysis of the magnetic structure and ferroelectric polarization of monoclinic MnSb2S4 by density functional theory calculations by Tian (2010)
10.1016/0921-4526(89)90664-9 / Phys. B Condens. Matter / Magnetic structure of the mineral berthierite FeSb2S4 by Wintenberger (1989)
10.1021/ja303952w / J. Am. Chem. Soc. / Chemical manipulation of magnetic ordering in Mn1xSnxBi2Se4 solid-solutions by Ranmohotti (2012)
10.1002/ejic.201100364 / Eur. J. Inorg. Chem. / Crystal structure, charge transport, and magnetic properties of MnSb2Se4 by Djieutedjeu (2011)
{'year': '1995', 'series-title': 'CRC Handbook of Thermoelectrics', 'author': 'Rowe', 'key': '10.1016/j.jallcom.2017.03.121_bib10'} / CRC Handbook of Thermoelectrics by Rowe (1995)
10.1126/science.1065389 / Science / Spintronics: a spin-based electronics vision for the future by Wolf (2001)
10.1364/AO.26.000224 / Appl. Opt. / V. Inorganic nonlinear materials for frequency conversion by Ballman (1987)
10.1039/c3ce40643a / CrystEngComm / Crystal structure, properties and nanostructuring of a new layered chalcogenide semiconductor, Bi2MnTe4 by Lee (2013)
10.1103/PhysRevB.48.13115 / Phys. Rev. B / Ab initio molecular dynamics for open-shell transition metals by Kresse (1993)
10.1103/PhysRevB.54.11169 / Phys. Rev. B / Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set by Kresse (1996)
10.1103/PhysRevLett.77.3865 / Phys. Rev. Lett. / Generalized gradient approximation made simple by Perdew (1996)
10.1103/PhysRevB.50.17953 / Phys. Rev. B / Projector augmented-wave method by Blöchl (1994)
10.1103/PhysRevB.59.1758 / Phys. Rev. B / From ultrasoft pseudopotentials to the projector augmented-wave method by Kresse (1999)
10.1103/PhysRevB.33.450 / Phys. Rev. B / Symmetry analysis and Monte Carlo study of a frustrated antiferromagnetic planar (XY) model in two dimensions by Lee (1986)
10.1063/1.3382344 / J. Chem. Phys. / A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu by Grimme (2010)
10.1103/PhysRevB.57.1505 / Phys. Rev. B / Electron-energy-loss spectra and the structural stability of nickel oxide: an LSDA+U study by Dudarev (1998)
10.4283/JMAG.2005.10.2.071 / J. Magnetics / Calculation of the Hubbard U parameters by the solid atom method by Youn (2005)
10.1016/j.jcrysgro.2016.11.090 / J. Cryst. Growth / Chemical vapor transport and characterization of MnBi2Se4 by Nowka (2017)
{'key': '10.1016/j.jallcom.2017.03.121_bib24', 'first-page': '909', 'article-title': 'System Sb2Te3–MnTe', 'volume': '27', 'author': 'Azhdarova', 'year': '1982', 'journal-title': 'J.\xa0Inorg. Chem. Transl. Zhurnal Neorganicheskoi Khimii)'} / J. Inorg. Chem. Transl. Zhurnal Neorganicheskoi Khimii) / System Sb2Te3–MnTe by Azhdarova (1982)
{'year': '2013', 'series-title': 'Ph. D. Dissertation: Complex Transition Metal Chalcogenide Ferromagnetic Semiconductor with General Formula MSb2Se4 (M=Mn,Fe): Synthesis and Characterization', 'author': 'Djieutedjeu', 'key': '10.1016/j.jallcom.2017.03.121_bib25'} / Ph. D. Dissertation: Complex Transition Metal Chalcogenide Ferromagnetic Semiconductor with General Formula MSb2Se4 (M=Mn,Fe): Synthesis and Characterization by Djieutedjeu (2013)

Dates

Type	When
Created	8 years, 5 months ago (March 16, 2017, 3:45 p.m.)
Deposited	3 years, 1 month ago (July 3, 2022, 6:09 p.m.)
Indexed	5 days, 18 hours ago (Aug. 19, 2025, 6:28 a.m.)
Issued	8 years, 2 months ago (June 1, 2017)
Published	8 years, 2 months ago (June 1, 2017)
Published Print	8 years, 2 months ago (June 1, 2017)

Funders 4

Basque Country Government, Departamento de Educación, Universidades e Investigación
Awards1
1. IT-756-13
Spanish Ministerio de Ciencia e Innovación 10.13039/501100004837 Ministerio de Ciencia e Innovación
Region: Europe
gov (National government)
Labels9
1. CienciaGob
2. Ministerio de Ciencia e Innovación de España
3. Ministry of Science and Innovation
4. Spanish Ministry of Science and Innovation
5. Ministry of Science and Innovation of Spain
6. Spain, Ministry for Science and Innovation
7. Ministeri de Ciència i Innovació
8. MCIN
9. MICINN
Awards1
1. FIS2010-19609-C02-01
Tomsk State University Academic D.I. Mendeleev Fund Program
Awards1
1. 8.1.05.2015
Saint Petersburg State University 10.13039/501100004285
Region: Europe
gov (National government)
Labels4
1. St Petersburg University
2. St. Petersburg State University
3. Saint-Petersburg State University
4. SPbU
Awards1
1. 15.61.202.2015

BibTeX

@article{Eremeev_2017, title={Competing rhombohedral and monoclinic crystal structures in <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si1.gif" overflow="scroll"><mml:mrow><mml:msub><mml:mrow><mml:mtext>MnPn</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mtext>Ch</mml:mtext></mml:mrow><mml:mn>4</mml:mn></mml:msub></mml:mrow></mml:math> compounds: An ab-initio study}, volume={709}, ISSN={0925-8388}, url={http://dx.doi.org/10.1016/j.jallcom.2017.03.121}, DOI={10.1016/j.jallcom.2017.03.121}, journal={Journal of Alloys and Compounds}, publisher={Elsevier BV}, author={Eremeev, S.V. and Otrokov, M.M. and Chulkov, E.V.}, year={2017}, month=jun, pages={172–178} }

JSON

{
  "indexed": {
    "date-parts": [
      [
        2025,
        8,
        19
      ]
    ],
    "date-time": "2025-08-19T10:28:38Z",
    "timestamp": 1755599318151,
    "version": "3.40.5"
  },
  "reference-count": 25,
  "publisher": "Elsevier BV",
  "license": [
    {
      "start": {
        "date-parts": [
          [
            2017,
            6,
            1
          ]
        ],
        "date-time": "2017-06-01T00:00:00Z",
        "timestamp": 1496275200000
      },
      "content-version": "tdm",
      "delay-in-days": 0,
      "URL": "https://www.elsevier.com/tdm/userlicense/1.0/"
    }
  ],
  "funder": [
    {
      "name": "Basque Country Government, Departamento de Educaci\u00f3n, Universidades e Investigaci\u00f3n",
      "award": [
        "IT-756-13"
      ]
    },
    {
      "DOI": "10.13039/501100004837",
      "name": "Spanish Ministerio de Ciencia e Innovaci\u00f3n",
      "doi-asserted-by": "crossref",
      "award": [
        "FIS2010-19609-C02-01"
      ],
      "id": [
        {
          "id": "10.13039/501100004837",
          "id-type": "DOI",
          "asserted-by": "crossref"
        }
      ]
    },
    {
      "name": "Tomsk State University Academic D.I. Mendeleev Fund Program",
      "award": [
        "8.1.05.2015"
      ]
    },
    {
      "DOI": "10.13039/501100004285",
      "name": "Saint Petersburg State University",
      "doi-asserted-by": "publisher",
      "award": [
        "15.61.202.2015"
      ],
      "id": [
        {
          "id": "10.13039/501100004285",
          "id-type": "DOI",
          "asserted-by": "publisher"
        }
      ]
    }
  ],
  "content-domain": {
    "domain": [
      "elsevier.com",
      "sciencedirect.com"
    ],
    "crossmark-restriction": true
  },
  "published-print": {
    "date-parts": [
      [
        2017,
        6
      ]
    ]
  },
  "DOI": "10.1016/j.jallcom.2017.03.121",
  "type": "journal-article",
  "created": {
    "date-parts": [
      [
        2017,
        3,
        16
      ]
    ],
    "date-time": "2017-03-16T19:45:29Z",
    "timestamp": 1489693529000
  },
  "page": "172-178",
  "update-policy": "https://doi.org/10.1016/elsevier_cm_policy",
  "source": "Crossref",
  "is-referenced-by-count": 66,
  "special_numbering": "C",
  "title": "Competing rhombohedral and monoclinic crystal structures in <mml:math xmlns:mml=\"http://www.w3.org/1998/Math/MathML\" altimg=\"si1.gif\" overflow=\"scroll\"><mml:mrow><mml:msub><mml:mrow><mml:mtext>MnPn</mml:mtext></mml:mrow><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mrow><mml:mtext>Ch</mml:mtext></mml:mrow><mml:mn>4</mml:mn></mml:msub></mml:mrow></mml:math> compounds: An ab-initio study",
  "prefix": "10.1016",
  "volume": "709",
  "author": [
    {
      "ORCID": "https://orcid.org/0000-0002-9477-3017",
      "authenticated-orcid": false,
      "given": "S.V.",
      "family": "Eremeev",
      "sequence": "first",
      "affiliation": []
    },
    {
      "given": "M.M.",
      "family": "Otrokov",
      "sequence": "additional",
      "affiliation": []
    },
    {
      "given": "E.V.",
      "family": "Chulkov",
      "sequence": "additional",
      "affiliation": []
    }
  ],
  "member": "78",
  "reference": [
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib1",
      "first-page": "31",
      "article-title": "Roentgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierite, FeSb2S4",
      "volume": "186",
      "author": "Bente",
      "year": "1989",
      "journal-title": "Z.\u00a0Krist."
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib2",
      "first-page": "226",
      "article-title": "The crystal structure of berthierite, FeSb2S4",
      "volume": "40",
      "author": "Buerger",
      "year": "1955",
      "journal-title": "Am. Mineralogist"
    },
    {
      "issue": "51",
      "key": "10.1016/j.jallcom.2017.03.121_bib3",
      "doi-asserted-by": "crossref",
      "first-page": "9977",
      "DOI": "10.1002/anie.201005458",
      "article-title": "Structural-distortion-driven cooperative magnetic and semiconductor-to-insulator transitions in ferromagnetic FeSb2Se4",
      "volume": "49",
      "author": "Djieutedjeu",
      "year": "2010",
      "journal-title": "Angew. Chem. Int. Ed."
    },
    {
      "issue": "4",
      "key": "10.1016/j.jallcom.2017.03.121_bib4",
      "doi-asserted-by": "crossref",
      "first-page": "201",
      "DOI": "10.1007/s00269-007-0213-3",
      "article-title": "Magnetic properties and neutron diffraction study of two manganese sulfosalts: monoclinic MnSb2S4 and benavidesite (MnPb4Sb6S14)",
      "volume": "35",
      "author": "L\u00e9one",
      "year": "2008",
      "journal-title": "Phys. Chem. Minerals"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib5",
      "doi-asserted-by": "crossref",
      "first-page": "235207",
      "DOI": "10.1103/PhysRevB.71.235207",
      "article-title": "Electronic structure of the antiferromagnetic semiconductor MnSb2S4",
      "volume": "71",
      "author": "Matar",
      "year": "2005",
      "journal-title": "Phys. Rev. B"
    },
    {
      "issue": "23",
      "key": "10.1016/j.jallcom.2017.03.121_bib6",
      "doi-asserted-by": "crossref",
      "first-page": "10956",
      "DOI": "10.1021/ic101351b",
      "article-title": "Analysis of the magnetic structure and ferroelectric polarization of monoclinic MnSb2S4 by density functional theory calculations",
      "volume": "49",
      "author": "Tian",
      "year": "2010",
      "journal-title": "Inorg. Chem."
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib7",
      "doi-asserted-by": "crossref",
      "first-page": "315",
      "DOI": "10.1016/0921-4526(89)90664-9",
      "article-title": "Magnetic structure of the mineral berthierite FeSb2S4",
      "volume": "156",
      "author": "Wintenberger",
      "year": "1989",
      "journal-title": "Phys. B Condens. Matter"
    },
    {
      "issue": "34",
      "key": "10.1016/j.jallcom.2017.03.121_bib8",
      "doi-asserted-by": "crossref",
      "first-page": "14033",
      "DOI": "10.1021/ja303952w",
      "article-title": "Chemical manipulation of magnetic ordering in Mn1xSnxBi2Se4 solid-solutions",
      "volume": "134",
      "author": "Ranmohotti",
      "year": "2012",
      "journal-title": "J.\u00a0Am. Chem. Soc."
    },
    {
      "issue": "26",
      "key": "10.1016/j.jallcom.2017.03.121_bib9",
      "doi-asserted-by": "crossref",
      "first-page": "3969",
      "DOI": "10.1002/ejic.201100364",
      "article-title": "Crystal structure, charge transport, and magnetic properties of MnSb2Se4",
      "volume": "2011",
      "author": "Djieutedjeu",
      "year": "2011",
      "journal-title": "Eur. J. Inorg. Chem."
    },
    {
      "year": "1995",
      "series-title": "CRC Handbook of Thermoelectrics",
      "author": "Rowe",
      "key": "10.1016/j.jallcom.2017.03.121_bib10"
    },
    {
      "issue": "5546",
      "key": "10.1016/j.jallcom.2017.03.121_bib11",
      "doi-asserted-by": "crossref",
      "first-page": "1488",
      "DOI": "10.1126/science.1065389",
      "article-title": "Spintronics: a spin-based electronics vision for the future",
      "volume": "294",
      "author": "Wolf",
      "year": "2001",
      "journal-title": "Science"
    },
    {
      "issue": "2",
      "key": "10.1016/j.jallcom.2017.03.121_bib12",
      "doi-asserted-by": "crossref",
      "first-page": "224",
      "DOI": "10.1364/AO.26.000224",
      "article-title": "V.\u00a0Inorganic nonlinear materials for frequency conversion",
      "volume": "26",
      "author": "Ballman",
      "year": "1987",
      "journal-title": "Appl. Opt."
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib13",
      "doi-asserted-by": "crossref",
      "first-page": "5532",
      "DOI": "10.1039/c3ce40643a",
      "article-title": "Crystal structure, properties and nanostructuring of a new layered chalcogenide semiconductor, Bi2MnTe4",
      "volume": "15",
      "author": "Lee",
      "year": "2013",
      "journal-title": "CrystEngComm"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib14",
      "doi-asserted-by": "crossref",
      "first-page": "13115",
      "DOI": "10.1103/PhysRevB.48.13115",
      "article-title": "Ab initio molecular dynamics for open-shell transition metals",
      "volume": "48",
      "author": "Kresse",
      "year": "1993",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib15",
      "doi-asserted-by": "crossref",
      "first-page": "11169",
      "DOI": "10.1103/PhysRevB.54.11169",
      "article-title": "Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set",
      "volume": "54",
      "author": "Kresse",
      "year": "1996",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib16",
      "doi-asserted-by": "crossref",
      "first-page": "3865",
      "DOI": "10.1103/PhysRevLett.77.3865",
      "article-title": "Generalized gradient approximation made simple",
      "volume": "77",
      "author": "Perdew",
      "year": "1996",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib17",
      "doi-asserted-by": "crossref",
      "first-page": "17953",
      "DOI": "10.1103/PhysRevB.50.17953",
      "article-title": "Projector augmented-wave method",
      "volume": "50",
      "author": "Bl\u00f6chl",
      "year": "1994",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib18",
      "doi-asserted-by": "crossref",
      "first-page": "1758",
      "DOI": "10.1103/PhysRevB.59.1758",
      "article-title": "From ultrasoft pseudopotentials to the projector augmented-wave method",
      "volume": "59",
      "author": "Kresse",
      "year": "1999",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib19",
      "doi-asserted-by": "crossref",
      "first-page": "450",
      "DOI": "10.1103/PhysRevB.33.450",
      "article-title": "Symmetry analysis and Monte Carlo study of a frustrated antiferromagnetic planar (XY) model in two dimensions",
      "volume": "33",
      "author": "Lee",
      "year": "1986",
      "journal-title": "Phys. Rev. B"
    },
    {
      "issue": "15",
      "key": "10.1016/j.jallcom.2017.03.121_bib20",
      "doi-asserted-by": "crossref",
      "first-page": "154104",
      "DOI": "10.1063/1.3382344",
      "article-title": "A\u00a0consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu",
      "volume": "132",
      "author": "Grimme",
      "year": "2010",
      "journal-title": "J.\u00a0Chem. Phys."
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib21",
      "doi-asserted-by": "crossref",
      "first-page": "1505",
      "DOI": "10.1103/PhysRevB.57.1505",
      "article-title": "Electron-energy-loss spectra and the structural stability of nickel oxide: an LSDA+U study",
      "volume": "57",
      "author": "Dudarev",
      "year": "1998",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib22",
      "doi-asserted-by": "crossref",
      "first-page": "71",
      "DOI": "10.4283/JMAG.2005.10.2.071",
      "article-title": "Calculation of the Hubbard U parameters by the solid atom method",
      "volume": "10",
      "author": "Youn",
      "year": "2005",
      "journal-title": "J.\u00a0Magnetics"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib23",
      "doi-asserted-by": "crossref",
      "first-page": "81",
      "DOI": "10.1016/j.jcrysgro.2016.11.090",
      "article-title": "Chemical vapor transport and characterization of MnBi2Se4",
      "volume": "459",
      "author": "Nowka",
      "year": "2017",
      "journal-title": "J.\u00a0Cryst. Growth"
    },
    {
      "key": "10.1016/j.jallcom.2017.03.121_bib24",
      "first-page": "909",
      "article-title": "System Sb2Te3\u2013MnTe",
      "volume": "27",
      "author": "Azhdarova",
      "year": "1982",
      "journal-title": "J.\u00a0Inorg. Chem. Transl. Zhurnal Neorganicheskoi Khimii)"
    },
    {
      "year": "2013",
      "series-title": "Ph. D. Dissertation: Complex Transition Metal Chalcogenide Ferromagnetic Semiconductor with General Formula MSb2Se4 (M=Mn,Fe): Synthesis and Characterization",
      "author": "Djieutedjeu",
      "key": "10.1016/j.jallcom.2017.03.121_bib25"
    }
  ],
  "container-title": "Journal of Alloys and Compounds",
  "original-title": [],
  "language": "en",
  "link": [
    {
      "URL": "https://api.elsevier.com/content/article/PII:S0925838817309015?httpAccept=text/xml",
      "content-type": "text/xml",
      "content-version": "vor",
      "intended-application": "text-mining"
    },
    {
      "URL": "https://api.elsevier.com/content/article/PII:S0925838817309015?httpAccept=text/plain",
      "content-type": "text/plain",
      "content-version": "vor",
      "intended-application": "text-mining"
    }
  ],
  "deposited": {
    "date-parts": [
      [
        2022,
        7,
        3
      ]
    ],
    "date-time": "2022-07-03T22:09:05Z",
    "timestamp": 1656886145000
  },
  "score": 1,
  "resource": {
    "primary": {
      "URL": "https://linkinghub.elsevier.com/retrieve/pii/S0925838817309015"
    }
  },
  "subtitle": [],
  "short-title": [],
  "issued": {
    "date-parts": [
      [
        2017,
        6
      ]
    ]
  },
  "references-count": 25,
  "alternative-id": [
    "S0925838817309015"
  ],
  "URL": "http://dx.doi.org/10.1016/j.jallcom.2017.03.121",
  "relation": {},
  "ISSN": [
    "0925-8388"
  ],
  "subject": [],
  "container-title-short": "Journal of Alloys and Compounds",
  "published": {
    "date-parts": [
      [
        2017,
        6
      ]
    ]
  },
  "assertion": [
    {
      "value": "Elsevier",
      "name": "publisher",
      "label": "This article is maintained by"
    },
    {
      "value": "Competing rhombohedral and monoclinic crystal structures in  compounds: An ab-initio study",
      "name": "articletitle",
      "label": "Article Title"
    },
    {
      "value": "Journal of Alloys and Compounds",
      "name": "journaltitle",
      "label": "Journal Title"
    },
    {
      "value": "https://doi.org/10.1016/j.jallcom.2017.03.121",
      "name": "articlelink",
      "label": "CrossRef DOI link to publisher maintained version"
    },
    {
      "value": "article",
      "name": "content_type",
      "label": "Content Type"
    },
    {
      "value": "\u00a9 2017 Elsevier B.V. All rights reserved.",
      "name": "copyright",
      "label": "Copyright"
    }
  ]
}