DOI: 10.1063/1.4789421. Many-body dispersion interactions from the exchange-hole dipole moment model

Many-body dispersion interactions from the exchange-hole dipole moment model

10.1063/1.4789421

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

In this article, we present the extension of the exchange-hole dipole moment model (XDM) of dispersion interactions to the calculation of two-body and three-body dispersion energy terms to any order, 2l-pole oscillator strengths, and polarizabilities. By using the newly-formulated coefficients, we study the relative importance of the higher-order two-body and the leading non-additive three-body (triple-dipole) interactions in gas-phase as well as in condensed systems. We show that the two-body terms up to R−10, but not the terms of higher-order, are essential in the correct description of the dispersion energy, while there are a number of difficulties related to the choice of the damping function, which precludes the use three-body triple-dipole contributions in XDM. We conclude that further study is required before the three-body term can be used in production XDM density-functional calculations and point out the salient problems regarding its use.

Bibliography

Otero-de-la-Roza, A., & Johnson, E. R. (2013). Many-body dispersion interactions from the exchange-hole dipole moment model. The Journal of Chemical Physics, 138(5).

Authors 2

A. Otero-de-la-Roza (first)
Erin R. Johnson (additional)

References 81 Referenced 68

{'volume-title': 'The Theory of Intermolecular Forces', 'year': '1997', 'key': '2023062523300944500_c1'} / The Theory of Intermolecular Forces (1997)
10.1002/poc.1606 / J. Phys. Org. Chem. (2009)
10.1557/mrs2010.581 / MRS Bull. (2010)
10.1088/0953-8984/24/7/073201 / J. Phys.: Condens. Matter (2012)
10.1103/PhysRevLett.82.2123 / Phys. Rev. Lett. (1999)
10.1103/PhysRevB.77.045136 / Phys. Rev. B (2008)
10.1088/0953-8984/21/8/084203 / J. Phys.: Condens. Matter (2009)
10.1103/PhysRevB.76.125112 / Phys. Rev. B (2007)
10.1103/PhysRevLett.92.246401 / Phys. Rev. Lett. (2004)
10.1103/PhysRevLett.93.153004 / Phys. Rev. Lett. (2004)
10.1103/PhysRevB.75.205131 / Phys. Rev. B (2007)
10.1016/j.cplett.2008.02.110 / Chem. Phys. Lett. (2008)
10.1063/1.2992078 / J. Chem. Phys. (2008)
10.1021/jp050536c / J. Phys. Chem. A (2005)
10.1021/ct0502763 / J. Chem. Theory Comput. (2006)
10.1103/PhysRevLett.102.073005 / Phys. Rev. Lett. (2009)
10.1103/PhysRevLett.108.236402 / Phys. Rev. Lett. (2012)
10.1002/jcc.20078 / J. Comput. Chem. (2004)
10.1002/jcc.20495 / J. Comput. Chem. (2006)
10.1063/1.3382344 / J. Chem. Phys. (2010)
10.1103/PhysRevLett.103.063004 / Phys. Rev. Lett. (2009)
10.1063/1.1949201 / J. Chem. Phys. (2005)
10.1063/1.1884601 / J. Chem. Phys. (2005)
10.1063/1.2065267 / J. Chem. Phys. (2005)
10.1063/1.2139668 / J. Chem. Phys. (2006)
10.1063/1.2190220 / J. Chem. Phys. (2006)
10.1016/j.cplett.2006.10.094 / Chem. Phys. Lett. (2006)
10.1063/1.2768530 / J. Chem. Phys. (2007)
10.1063/1.2795701 / J. Chem. Phys. (2007)
10.1021/ct800522r / J. Chem. Theory Comput. (2009)
10.1021/ct900699r / J. Chem. Theory Comput. (2010)
10.1139/V10-073 / Can. J. Chem. (2010)
10.1063/1.4705760 / J. Chem. Phys. (2012)
10.1063/1.3670015 / J. Chem. Phys. (2011)
10.1063/1.4738961 / J. Chem. Phys. (2012)
10.1103/RevModPhys.11.1 / Rev. Mod. Phys. (1939)
10.1063/1.1743991 / J. Chem. Phys. (1957)
10.1103/PhysRevB.78.045116 / Phys. Rev. B (2008)
10.1021/jp808767y / J. Phys. Chem. A (2009)
10.1063/1.3432765 / J. Chem. Phys. (2010)
10.1073/pnas.1208121109 / Proc. Natl. Acad. Sci. U.S.A. (2012)
10.1021/ct200541h / J. Chem. Theory Comput. (2011)
10.1073/pnas.1118245108 / Proc. Natl. Acad. Sci. U.S.A. (2012)
10.1063/1.2337283 / J. Chem. Phys. (2006)
10.1080/00268970500224523 / Mol. Phys. (2006)
10.1039/b211731m / Phys. Chem. Chem. Phys. (2003)
10.1007/BF00549096 / Theor. Chim. Acta (1977)
10.1103/PhysRevA.39.3761 / Phys. Rev. A (1989)
10.1063/1.3676064 / J. Chem. Phys. (2012)
{'key': '2023062523300944500_c50', 'volume-title': 'CRC Handbook of Chemistry and Physics', 'author': 'Lide', 'year': '2010', 'edition': '90th ed.'} / CRC Handbook of Chemistry and Physics by Lide (2010)
10.1063/1.3672236 / J. Chem. Phys. (2012)
10.1002/qua.560360862 / Int. J. Quantum Chem., Symp. (1989)
10.1063/1.457869 / J. Chem. Phys. (1990)
10.1063/1.455105 / J. Chem. Phys. (1988)
10.1103/PhysRevA.71.042701 / Phys. Rev. A (2005)
10.1103/PhysRevA.68.052714 / Phys. Rev. A (2003)
10.1063/1.3577967 / J. Chem. Phys. (2011)
10.1063/1.447150 / J. Chem. Phys. (1984)
10.1103/PhysRevA.86.012505 / Phys. Rev. A (2012)
10.1103/PhysRev.177.108 / Phys. Rev. (1969)
10.1088/0370-1298/69/1/307 / Proc. Phys. Soc., London, Sect. A (1956)
10.1088/0022-3700/3/6/003 / J. Phys. B (1970)
10.1063/1.3691891 / J. Chem. Phys. (2012)
10.1063/1.1723844 / J. Chem. Phys. (1943)
{'key': '2023062523300944500_c65', 'first-page': '629', 'volume': '17', 'year': '1943', 'journal-title': 'J. Phys. Math. Soc. Jpn.'} / J. Phys. Math. Soc. Jpn. (1943)
10.1143/JPSJ.11.1045 / J. Phys. Soc. Jpn. (1956)
10.1103/PhysRevA.55.2067 / Phys. Rev. A (1997)
10.1080/01442350601081931 / Int. Rev. Phys. Chem. (2007)
10.1016/0301-0104(95)00060-2 / Chem. Phys. (1995)
10.1002/jcc.21759 / J. Comput. Chem. (2011)
10.1021/ct700105f / J. Chem. Theory Comput. (2008)
10.1021/ct900545v / J. Chem. Theory Comput. (2010)
10.1021/jp072106n / J. Phys. Chem. A (2007)
10.1063/1.3204319 / J. Chem. Phys. (2009)
10.1103/PhysRevB.33.8800 / Phys. Rev. B (1986)
10.1103/PhysRevLett.77.3865 / Phys. Rev. Lett. (1996)
10.1016/j.cpc.2010.04.018 / Comput. Phys. Commun. (2010)
10.1103/PhysRevLett.101.115503 / Phys. Rev. Lett. (2008)
10.1103/PhysRevLett.79.1301 / Phys. Rev. Lett. (1997)
10.1103/PhysRevB.62.5482 / Phys. Rev. B (2000)
See supplementary material at http://dx.doi.org/10.1063/1.4789421 for the tables mentioned in the text. (10.1063/1.4789421)

Dates

Type	When
Created	12 years, 6 months ago (Feb. 1, 2013, 7:36 p.m.)
Deposited	2 years, 1 month ago (June 25, 2023, 7:30 p.m.)
Indexed	3 weeks, 3 days ago (July 30, 2025, 6:59 a.m.)
Issued	12 years, 6 months ago (Feb. 1, 2013)
Published	12 years, 6 months ago (Feb. 1, 2013)
Published Online	12 years, 6 months ago (Feb. 1, 2013)
Published Print	12 years, 6 months ago (Feb. 7, 2013)

Funders 0

None

BibTeX

@article{Otero_de_la_Roza_2013, title={Many-body dispersion interactions from the exchange-hole dipole moment model}, volume={138}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.4789421}, DOI={10.1063/1.4789421}, number={5}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Otero-de-la-Roza, A. and Johnson, Erin R.}, year={2013}, month=feb }

JSON

{
  "indexed": {
    "date-parts": [
      [
        2025,
        7,
        30
      ]
    ],
    "date-time": "2025-07-30T10:59:48Z",
    "timestamp": 1753873188842,
    "version": "3.41.2"
  },
  "reference-count": 81,
  "publisher": "AIP Publishing",
  "issue": "5",
  "content-domain": {
    "domain": [
      "pubs.aip.org"
    ],
    "crossmark-restriction": true
  },
  "published-print": {
    "date-parts": [
      [
        2013,
        2,
        7
      ]
    ]
  },
  "abstract": "<jats:p>In this article, we present the extension of the exchange-hole dipole moment model (XDM) of dispersion interactions to the calculation of two-body and three-body dispersion energy terms to any order, 2l-pole oscillator strengths, and polarizabilities. By using the newly-formulated coefficients, we study the relative importance of the higher-order two-body and the leading non-additive three-body (triple-dipole) interactions in gas-phase as well as in condensed systems. We show that the two-body terms up to R\u221210, but not the terms of higher-order, are essential in the correct description of the dispersion energy, while there are a number of difficulties related to the choice of the damping function, which precludes the use three-body triple-dipole contributions in XDM. We conclude that further study is required before the three-body term can be used in production XDM density-functional calculations and point out the salient problems regarding its use.</jats:p>",
  "DOI": "10.1063/1.4789421",
  "type": "journal-article",
  "created": {
    "date-parts": [
      [
        2013,
        2,
        2
      ]
    ],
    "date-time": "2013-02-02T00:36:23Z",
    "timestamp": 1359765383000
  },
  "update-policy": "https://doi.org/10.1063/aip-crossmark-policy-page",
  "source": "Crossref",
  "is-referenced-by-count": 68,
  "title": "Many-body dispersion interactions from the exchange-hole dipole moment model",
  "prefix": "10.1063",
  "volume": "138",
  "author": [
    {
      "given": "A.",
      "family": "Otero-de-la-Roza",
      "sequence": "first",
      "affiliation": [
        {
          "name": "University of California Chemistry and Chemical Biology, School of Natural Sciences, , Merced, 5200 North Lake Road, Merced, California 95343, USA"
        }
      ]
    },
    {
      "given": "Erin R.",
      "family": "Johnson",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "University of California Chemistry and Chemical Biology, School of Natural Sciences, , Merced, 5200 North Lake Road, Merced, California 95343, USA"
        }
      ]
    }
  ],
  "member": "317",
  "published-online": {
    "date-parts": [
      [
        2013,
        2,
        1
      ]
    ]
  },
  "reference": [
    {
      "volume-title": "The Theory of Intermolecular Forces",
      "year": "1997",
      "key": "2023062523300944500_c1"
    },
    {
      "key": "2023062523300944500_c2",
      "doi-asserted-by": "publisher",
      "first-page": "1127",
      "DOI": "10.1002/poc.1606",
      "volume": "22",
      "year": "2009",
      "journal-title": "J. Phys. Org. Chem."
    },
    {
      "key": "2023062523300944500_c3",
      "doi-asserted-by": "publisher",
      "first-page": "435",
      "DOI": "10.1557/mrs2010.581",
      "volume": "35",
      "year": "2010",
      "journal-title": "MRS Bull."
    },
    {
      "key": "2023062523300944500_c4",
      "doi-asserted-by": "publisher",
      "first-page": "073201",
      "DOI": "10.1088/0953-8984/24/7/073201",
      "volume": "24",
      "year": "2012",
      "journal-title": "J. Phys.: Condens. Matter"
    },
    {
      "key": "2023062523300944500_c5",
      "doi-asserted-by": "publisher",
      "first-page": "2123",
      "DOI": "10.1103/PhysRevLett.82.2123",
      "volume": "82",
      "year": "1999",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c6",
      "doi-asserted-by": "publisher",
      "first-page": "045136",
      "DOI": "10.1103/PhysRevB.77.045136",
      "volume": "77",
      "year": "2008",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c7",
      "doi-asserted-by": "publisher",
      "first-page": "084203",
      "DOI": "10.1088/0953-8984/21/8/084203",
      "volume": "21",
      "year": "2009",
      "journal-title": "J. Phys.: Condens. Matter"
    },
    {
      "key": "2023062523300944500_c8",
      "doi-asserted-by": "publisher",
      "first-page": "125112",
      "DOI": "10.1103/PhysRevB.76.125112",
      "volume": "76",
      "year": "2007",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c9",
      "doi-asserted-by": "publisher",
      "first-page": "246401",
      "DOI": "10.1103/PhysRevLett.92.246401",
      "volume": "92",
      "year": "2004",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c10",
      "doi-asserted-by": "publisher",
      "first-page": "153004",
      "DOI": "10.1103/PhysRevLett.93.153004",
      "volume": "93",
      "year": "2004",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c11",
      "doi-asserted-by": "publisher",
      "first-page": "205131",
      "DOI": "10.1103/PhysRevB.75.205131",
      "volume": "75",
      "year": "2007",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c12",
      "doi-asserted-by": "publisher",
      "first-page": "348",
      "DOI": "10.1016/j.cplett.2008.02.110",
      "volume": "455",
      "year": "2008",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "2023062523300944500_c13",
      "doi-asserted-by": "publisher",
      "first-page": "154102",
      "DOI": "10.1063/1.2992078",
      "volume": "129",
      "year": "2008",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c14",
      "doi-asserted-by": "publisher",
      "first-page": "5656",
      "DOI": "10.1021/jp050536c",
      "volume": "109",
      "year": "2005",
      "journal-title": "J. Phys. Chem. A"
    },
    {
      "key": "2023062523300944500_c15",
      "doi-asserted-by": "publisher",
      "first-page": "364",
      "DOI": "10.1021/ct0502763",
      "volume": "2",
      "year": "2006",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c16",
      "doi-asserted-by": "publisher",
      "first-page": "073005",
      "DOI": "10.1103/PhysRevLett.102.073005",
      "volume": "102",
      "year": "2009",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c17",
      "doi-asserted-by": "publisher",
      "first-page": "236402",
      "DOI": "10.1103/PhysRevLett.108.236402",
      "volume": "108",
      "year": "2012",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c18",
      "doi-asserted-by": "publisher",
      "first-page": "1463",
      "DOI": "10.1002/jcc.20078",
      "volume": "25",
      "year": "2004",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "2023062523300944500_c19",
      "doi-asserted-by": "publisher",
      "first-page": "1787",
      "DOI": "10.1002/jcc.20495",
      "volume": "27",
      "year": "2006",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "2023062523300944500_c20",
      "doi-asserted-by": "publisher",
      "first-page": "154104",
      "DOI": "10.1063/1.3382344",
      "volume": "132",
      "year": "2010",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c21",
      "doi-asserted-by": "publisher",
      "first-page": "063004",
      "DOI": "10.1103/PhysRevLett.103.063004",
      "volume": "103",
      "year": "2009",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c22",
      "doi-asserted-by": "publisher",
      "first-page": "024101",
      "DOI": "10.1063/1.1949201",
      "volume": "123",
      "year": "2005",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c23",
      "doi-asserted-by": "publisher",
      "first-page": "154104",
      "DOI": "10.1063/1.1884601",
      "volume": "122",
      "year": "2005",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c24",
      "doi-asserted-by": "publisher",
      "first-page": "154101",
      "DOI": "10.1063/1.2065267",
      "volume": "123",
      "year": "2005",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c25",
      "doi-asserted-by": "publisher",
      "first-page": "014104",
      "DOI": "10.1063/1.2139668",
      "volume": "124",
      "year": "2006",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c26",
      "doi-asserted-by": "publisher",
      "first-page": "174104",
      "DOI": "10.1063/1.2190220",
      "volume": "124",
      "year": "2006",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c27",
      "doi-asserted-by": "publisher",
      "first-page": "600",
      "DOI": "10.1016/j.cplett.2006.10.094",
      "volume": "432",
      "year": "2006",
      "journal-title": "Chem. Phys. Lett."
    },
    {
      "key": "2023062523300944500_c28",
      "doi-asserted-by": "publisher",
      "first-page": "124108",
      "DOI": "10.1063/1.2768530",
      "volume": "127",
      "year": "2007",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c29",
      "doi-asserted-by": "publisher",
      "first-page": "154108",
      "DOI": "10.1063/1.2795701",
      "volume": "127",
      "year": "2007",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c30",
      "doi-asserted-by": "publisher",
      "first-page": "719",
      "DOI": "10.1021/ct800522r",
      "volume": "5",
      "year": "2009",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c31",
      "doi-asserted-by": "publisher",
      "first-page": "1081",
      "DOI": "10.1021/ct900699r",
      "volume": "6",
      "year": "2010",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c32",
      "doi-asserted-by": "publisher",
      "first-page": "1057",
      "DOI": "10.1139/V10-073",
      "volume": "88",
      "year": "2010",
      "journal-title": "Can. J. Chem."
    },
    {
      "key": "2023062523300944500_c33",
      "doi-asserted-by": "publisher",
      "first-page": "174109",
      "DOI": "10.1063/1.4705760",
      "volume": "136",
      "year": "2012",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c34",
      "doi-asserted-by": "publisher",
      "first-page": "234109",
      "DOI": "10.1063/1.3670015",
      "volume": "135",
      "year": "2011",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c35",
      "doi-asserted-by": "publisher",
      "first-page": "054103",
      "DOI": "10.1063/1.4738961",
      "volume": "137",
      "year": "2012",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c36",
      "doi-asserted-by": "publisher",
      "first-page": "1",
      "DOI": "10.1103/RevModPhys.11.1",
      "volume": "11",
      "year": "1939",
      "journal-title": "Rev. Mod. Phys."
    },
    {
      "key": "2023062523300944500_c37",
      "doi-asserted-by": "publisher",
      "first-page": "1280",
      "DOI": "10.1063/1.1743991",
      "volume": "27",
      "year": "1957",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c38",
      "doi-asserted-by": "publisher",
      "first-page": "045116",
      "DOI": "10.1103/PhysRevB.78.045116",
      "volume": "78",
      "year": "2008",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c39",
      "doi-asserted-by": "publisher",
      "first-page": "2075",
      "DOI": "10.1021/jp808767y",
      "volume": "113",
      "year": "2009",
      "journal-title": "J. Phys. Chem. A"
    },
    {
      "key": "2023062523300944500_c40",
      "doi-asserted-by": "publisher",
      "first-page": "234109",
      "DOI": "10.1063/1.3432765",
      "volume": "132",
      "year": "2010",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c41",
      "doi-asserted-by": "publisher",
      "first-page": "14791",
      "DOI": "10.1073/pnas.1208121109",
      "volume": "109",
      "year": "2012",
      "journal-title": "Proc. Natl. Acad. Sci. U.S.A."
    },
    {
      "key": "2023062523300944500_c42",
      "doi-asserted-by": "publisher",
      "first-page": "3733",
      "DOI": "10.1021/ct200541h",
      "volume": "7",
      "year": "2011",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c43",
      "doi-asserted-by": "publisher",
      "first-page": "18",
      "DOI": "10.1073/pnas.1118245108",
      "volume": "109",
      "year": "2012",
      "journal-title": "Proc. Natl. Acad. Sci. U.S.A."
    },
    {
      "key": "2023062523300944500_c44",
      "doi-asserted-by": "publisher",
      "first-page": "074713",
      "DOI": "10.1063/1.2337283",
      "volume": "125",
      "year": "2006",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c45",
      "doi-asserted-by": "publisher",
      "first-page": "23",
      "DOI": "10.1080/00268970500224523",
      "volume": "104",
      "year": "2006",
      "journal-title": "Mol. Phys."
    },
    {
      "key": "2023062523300944500_c46",
      "doi-asserted-by": "publisher",
      "first-page": "801",
      "DOI": "10.1039/b211731m",
      "volume": "5",
      "year": "2003",
      "journal-title": "Phys. Chem. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c47",
      "doi-asserted-by": "publisher",
      "first-page": "129",
      "DOI": "10.1007/BF00549096",
      "volume": "44",
      "year": "1977",
      "journal-title": "Theor. Chim. Acta"
    },
    {
      "key": "2023062523300944500_c48",
      "doi-asserted-by": "publisher",
      "first-page": "3761",
      "DOI": "10.1103/PhysRevA.39.3761",
      "volume": "39",
      "year": "1989",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2023062523300944500_c49",
      "doi-asserted-by": "publisher",
      "first-page": "034109",
      "DOI": "10.1063/1.3676064",
      "volume": "136",
      "year": "2012",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c50",
      "volume-title": "CRC Handbook of Chemistry and Physics",
      "author": "Lide",
      "year": "2010",
      "edition": "90th ed."
    },
    {
      "key": "2023062523300944500_c51",
      "doi-asserted-by": "publisher",
      "first-page": "014104",
      "DOI": "10.1063/1.3672236",
      "volume": "136",
      "year": "2012",
      "journal-title": "J. Chem. Phys."
    },
    {
      "issue": "S23",
      "key": "2023062523300944500_c52",
      "doi-asserted-by": "publisher",
      "first-page": "599",
      "DOI": "10.1002/qua.560360862",
      "volume": "36",
      "year": "1989",
      "journal-title": "Int. J. Quantum Chem., Symp."
    },
    {
      "key": "2023062523300944500_c53",
      "doi-asserted-by": "publisher",
      "first-page": "3610",
      "DOI": "10.1063/1.457869",
      "volume": "92",
      "year": "1990",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c54",
      "doi-asserted-by": "publisher",
      "first-page": "2092",
      "DOI": "10.1063/1.455105",
      "volume": "89",
      "year": "1988",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c55",
      "doi-asserted-by": "publisher",
      "first-page": "042701",
      "DOI": "10.1103/PhysRevA.71.042701",
      "volume": "71",
      "year": "2005",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2023062523300944500_c56",
      "doi-asserted-by": "publisher",
      "first-page": "052714",
      "DOI": "10.1103/PhysRevA.68.052714",
      "volume": "68",
      "year": "2003",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2023062523300944500_c57",
      "doi-asserted-by": "publisher",
      "first-page": "144110",
      "DOI": "10.1063/1.3577967",
      "volume": "134",
      "year": "2011",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c58",
      "doi-asserted-by": "publisher",
      "first-page": "3726",
      "DOI": "10.1063/1.447150",
      "volume": "80",
      "year": "1984",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c59",
      "doi-asserted-by": "publisher",
      "first-page": "012505",
      "DOI": "10.1103/PhysRevA.86.012505",
      "volume": "86",
      "year": "2012",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2023062523300944500_c60",
      "doi-asserted-by": "publisher",
      "first-page": "108",
      "DOI": "10.1103/PhysRev.177.108",
      "volume": "177",
      "year": "1969",
      "journal-title": "Phys. Rev."
    },
    {
      "key": "2023062523300944500_c61",
      "doi-asserted-by": "publisher",
      "first-page": "57",
      "DOI": "10.1088/0370-1298/69/1/307",
      "volume": "69",
      "year": "1956",
      "journal-title": "Proc. Phys. Soc., London, Sect. A"
    },
    {
      "key": "2023062523300944500_c62",
      "doi-asserted-by": "publisher",
      "first-page": "751",
      "DOI": "10.1088/0022-3700/3/6/003",
      "volume": "3",
      "year": "1970",
      "journal-title": "J. Phys. B"
    },
    {
      "key": "2023062523300944500_c63",
      "doi-asserted-by": "publisher",
      "first-page": "104104",
      "DOI": "10.1063/1.3691891",
      "volume": "136",
      "year": "2012",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c64",
      "doi-asserted-by": "publisher",
      "first-page": "299",
      "DOI": "10.1063/1.1723844",
      "volume": "11",
      "year": "1943",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c65",
      "first-page": "629",
      "volume": "17",
      "year": "1943",
      "journal-title": "J. Phys. Math. Soc. Jpn."
    },
    {
      "key": "2023062523300944500_c66",
      "doi-asserted-by": "publisher",
      "first-page": "1045",
      "DOI": "10.1143/JPSJ.11.1045",
      "volume": "11",
      "year": "1956",
      "journal-title": "J. Phys. Soc. Jpn."
    },
    {
      "key": "2023062523300944500_c67",
      "doi-asserted-by": "publisher",
      "first-page": "2067",
      "DOI": "10.1103/PhysRevA.55.2067",
      "volume": "55",
      "year": "1997",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2023062523300944500_c68",
      "doi-asserted-by": "publisher",
      "first-page": "193",
      "DOI": "10.1080/01442350601081931",
      "volume": "26",
      "year": "2007",
      "journal-title": "Int. Rev. Phys. Chem."
    },
    {
      "key": "2023062523300944500_c69",
      "doi-asserted-by": "publisher",
      "first-page": "81",
      "DOI": "10.1016/0301-0104(95)00060-2",
      "volume": "196",
      "year": "1995",
      "journal-title": "Chem. Phys."
    },
    {
      "key": "2023062523300944500_c70",
      "doi-asserted-by": "publisher",
      "first-page": "1456",
      "DOI": "10.1002/jcc.21759",
      "volume": "32",
      "year": "2011",
      "journal-title": "J. Comput. Chem."
    },
    {
      "key": "2023062523300944500_c71",
      "doi-asserted-by": "publisher",
      "first-page": "19",
      "DOI": "10.1021/ct700105f",
      "volume": "4",
      "year": "2008",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c72",
      "doi-asserted-by": "publisher",
      "first-page": "155",
      "DOI": "10.1021/ct900545v",
      "volume": "6",
      "year": "2010",
      "journal-title": "J. Chem. Theory Comput."
    },
    {
      "key": "2023062523300944500_c73",
      "doi-asserted-by": "publisher",
      "first-page": "11311",
      "DOI": "10.1021/jp072106n",
      "volume": "111",
      "year": "2007",
      "journal-title": "J. Phys. Chem. A"
    },
    {
      "key": "2023062523300944500_c74",
      "doi-asserted-by": "publisher",
      "first-page": "064105",
      "DOI": "10.1063/1.3204319",
      "volume": "131",
      "year": "2009",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2023062523300944500_c75",
      "doi-asserted-by": "publisher",
      "first-page": "8800",
      "DOI": "10.1103/PhysRevB.33.8800",
      "volume": "33",
      "year": "1986",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c76",
      "doi-asserted-by": "publisher",
      "first-page": "3865",
      "DOI": "10.1103/PhysRevLett.77.3865",
      "volume": "77",
      "year": "1996",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c77",
      "doi-asserted-by": "publisher",
      "first-page": "1477",
      "DOI": "10.1016/j.cpc.2010.04.018",
      "volume": "181",
      "year": "2010",
      "journal-title": "Comput. Phys. Commun."
    },
    {
      "key": "2023062523300944500_c78",
      "doi-asserted-by": "publisher",
      "first-page": "115503",
      "DOI": "10.1103/PhysRevLett.101.115503",
      "volume": "101",
      "year": "2008",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c79",
      "doi-asserted-by": "publisher",
      "first-page": "1301",
      "DOI": "10.1103/PhysRevLett.79.1301",
      "volume": "79",
      "year": "1997",
      "journal-title": "Phys. Rev. Lett."
    },
    {
      "key": "2023062523300944500_c80",
      "doi-asserted-by": "publisher",
      "first-page": "5482",
      "DOI": "10.1103/PhysRevB.62.5482",
      "volume": "62",
      "year": "2000",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2023062523300944500_c81",
      "doi-asserted-by": "crossref",
      "unstructured": "See supplementary material at http://dx.doi.org/10.1063/1.4789421 for the tables mentioned in the text.",
      "DOI": "10.1063/1.4789421"
    }
  ],
  "container-title": "The Journal of Chemical Physics",
  "original-title": [],
  "language": "en",
  "link": [
    {
      "URL": "https://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/1.4789421/13309719/054103_1_online.pdf",
      "content-type": "application/pdf",
      "content-version": "vor",
      "intended-application": "syndication"
    },
    {
      "URL": "https://pubs.aip.org/aip/jcp/article-pdf/doi/10.1063/1.4789421/13309719/054103_1_online.pdf",
      "content-type": "unspecified",
      "content-version": "vor",
      "intended-application": "similarity-checking"
    }
  ],
  "deposited": {
    "date-parts": [
      [
        2023,
        6,
        25
      ]
    ],
    "date-time": "2023-06-25T23:30:15Z",
    "timestamp": 1687735815000
  },
  "score": 1,
  "resource": {
    "primary": {
      "URL": "https://pubs.aip.org/jcp/article/138/5/054103/193127/Many-body-dispersion-interactions-from-the"
    }
  },
  "subtitle": [],
  "short-title": [],
  "issued": {
    "date-parts": [
      [
        2013,
        2,
        1
      ]
    ]
  },
  "references-count": 81,
  "journal-issue": {
    "issue": "5",
    "published-print": {
      "date-parts": [
        [
          2013,
          2,
          7
        ]
      ]
    }
  },
  "URL": "http://dx.doi.org/10.1063/1.4789421",
  "relation": {},
  "ISSN": [
    "0021-9606",
    "1089-7690"
  ],
  "subject": [],
  "published-other": {
    "date-parts": [
      [
        2013,
        2,
        7
      ]
    ]
  },
  "published": {
    "date-parts": [
      [
        2013,
        2,
        1
      ]
    ]
  },
  "article-number": "054103"
}