DOI: 10.1063/1.448954. Consequences of the balance between the repulsive and attractive forces in dense, nonassociated liquids

Consequences of the balance between the repulsive and attractive forces in dense, nonassociated liquids

10.1063/1.448954

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

Current theories successfully predict the equilibrium structure of many simple liquids near their triple point from the repulsive molecular forces alone. We present a simple model substance whose liquid structure cannot be predicted adequately with only the repulsions. Furthermore, the model’s crystal structure changes drastically upon the removal of the attractions. This failure for our model to conform to the accepted picture of simple liquids gives us the opportunity to sharpen the boundary between substances which, respectively, may and may not be expected to so conform. We conclude that the structure of the corresponding solid deserves more weight than is conventionally given by modern theories of liquids.

Bibliography

LaViolette, R. A., & Stillinger, F. H. (1985). Consequences of the balance between the repulsive and attractive forces in dense, nonassociated liquids. The Journal of Chemical Physics, 82(7), 3335â3343.

Authors 2

Randall A. LaViolette (first)
Frank H. Stillinger (additional)

References 21 Referenced 11

10.1126/science.220.4599.787 / Science (1983)
{'key': '2024021001531572000_r2', 'first-page': '105', 'volume': '34', 'year': '1976', 'journal-title': 'Adv. Chem. Phys.'} / Adv. Chem. Phys. (1976)
{'key': '2024021001531572000_r3', 'first-page': '24', 'volume': '33', 'year': '1980', 'journal-title': 'Phys. Today'} / Phys. Today (1980)
10.1063/1.445097 / J. Chem. Phys. (1983)
{'key': '2024021001531572000_r5', 'first-page': '78', 'volume': '66', 'year': '1978', 'journal-title': 'Faraday Discuss. Chem. Soc.'} / Faraday Discuss. Chem. Soc. (1978)
10.1103/PhysRevA.28.2408 / Phys. Rev. A (1983)
10.1103/PhysRevA.30.2781 / Phys. Rev. A (1984)
{'key': '2024021001531572000_r8'}
{'key': '2024021001531572000_r9'}
{'key': '2024021001531572000_r10'}
{'key': '2024021001531572000_r11'}
{'key': '2024021001531572000_r12'}
{'key': '2024021001531572000_r13'}
10.1016/0038-1098(84)90683-5 / Solid State Comm. (1984)
10.1103/PhysRevB.20.299 / Phys. Rev. B (1979)
{'key': '2024021001531572000_r15'}
{'key': '2024021001531572000_r16'}
{'key': '2024021001531572000_r17'}
{'key': '2024021001531572000_r18'}
10.1103/PhysRevA.5.939 / Phys. Rev. A (1972)
10.1063/1.447223 / J. Chem. Phys. (1984)

Dates

Type	When
Created	23 years, 1 month ago (July 26, 2002, 9 a.m.)
Deposited	1 year, 6 months ago (Feb. 9, 2024, 10:07 p.m.)
Indexed	1 year, 6 months ago (Feb. 10, 2024, 4:19 a.m.)
Issued	40 years, 5 months ago (April 1, 1985)
Published	40 years, 5 months ago (April 1, 1985)
Published Print	40 years, 5 months ago (April 1, 1985)

Funders 0

None

BibTeX

@article{LaViolette_1985, title={Consequences of the balance between the repulsive and attractive forces in dense, nonassociated liquids}, volume={82}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.448954}, DOI={10.1063/1.448954}, number={7}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={LaViolette, Randall A. and Stillinger, Frank H.}, year={1985}, month=apr, pages={3335–3343} }

JSON

{
  "indexed": {
    "date-parts": [
      [
        2024,
        2,
        10
      ]
    ],
    "date-time": "2024-02-10T09:19:53Z",
    "timestamp": 1707556793271
  },
  "reference-count": 21,
  "publisher": "AIP Publishing",
  "issue": "7",
  "content-domain": {
    "domain": [
      "pubs.aip.org"
    ],
    "crossmark-restriction": true
  },
  "published-print": {
    "date-parts": [
      [
        1985,
        4,
        1
      ]
    ]
  },
  "abstract": "<jats:p>Current theories successfully predict the equilibrium structure of many simple liquids near their triple point from the repulsive molecular forces alone. We present a simple model substance whose liquid structure cannot be predicted adequately with only the repulsions. Furthermore, the model\u2019s crystal structure changes drastically upon the removal of the attractions. This failure for our model to conform to the accepted picture of simple liquids gives us the opportunity to sharpen the boundary between substances which, respectively, may and may not be expected to so conform. We conclude that the structure of the corresponding solid deserves more weight than is conventionally given by modern theories of liquids.</jats:p>",
  "DOI": "10.1063/1.448954",
  "type": "journal-article",
  "created": {
    "date-parts": [
      [
        2002,
        7,
        26
      ]
    ],
    "date-time": "2002-07-26T13:00:36Z",
    "timestamp": 1027688436000
  },
  "page": "3335-3343",
  "update-policy": "http://dx.doi.org/10.1063/aip-crossmark-policy-page",
  "source": "Crossref",
  "is-referenced-by-count": 11,
  "title": "Consequences of the balance between the repulsive and attractive forces in dense, nonassociated liquids",
  "prefix": "10.1063",
  "volume": "82",
  "author": [
    {
      "given": "Randall A.",
      "family": "LaViolette",
      "sequence": "first",
      "affiliation": [
        {
          "name": "AT&T Bell Laboratories, Murray Hill, New Jersey 07974"
        }
      ]
    },
    {
      "given": "Frank H.",
      "family": "Stillinger",
      "sequence": "additional",
      "affiliation": [
        {
          "name": "AT&T Bell Laboratories, Murray Hill, New Jersey 07974"
        }
      ]
    }
  ],
  "member": "317",
  "reference": [
    {
      "key": "2024021001531572000_r1",
      "doi-asserted-by": "crossref",
      "first-page": "787",
      "DOI": "10.1126/science.220.4599.787",
      "volume": "220",
      "year": "1983",
      "journal-title": "Science"
    },
    {
      "key": "2024021001531572000_r2",
      "first-page": "105",
      "volume": "34",
      "year": "1976",
      "journal-title": "Adv. Chem. Phys."
    },
    {
      "key": "2024021001531572000_r3",
      "first-page": "24",
      "volume": "33",
      "year": "1980",
      "journal-title": "Phys. Today"
    },
    {
      "key": "2024021001531572000_r4",
      "doi-asserted-by": "crossref",
      "first-page": "4197",
      "DOI": "10.1063/1.445097",
      "volume": "78",
      "year": "1983",
      "journal-title": "J. Chem. Phys."
    },
    {
      "key": "2024021001531572000_r5",
      "first-page": "78",
      "volume": "66",
      "year": "1978",
      "journal-title": "Faraday Discuss. Chem. Soc."
    },
    {
      "key": "2024021001531572000_r6",
      "doi-asserted-by": "crossref",
      "first-page": "2408",
      "DOI": "10.1103/PhysRevA.28.2408",
      "volume": "28",
      "year": "1983",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2024021001531572000_r7",
      "doi-asserted-by": "crossref",
      "first-page": "2781",
      "DOI": "10.1103/PhysRevA.30.2781",
      "volume": "30",
      "year": "1984",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2024021001531572000_r8"
    },
    {
      "key": "2024021001531572000_r9"
    },
    {
      "key": "2024021001531572000_r10"
    },
    {
      "key": "2024021001531572000_r11"
    },
    {
      "key": "2024021001531572000_r12"
    },
    {
      "key": "2024021001531572000_r13"
    },
    {
      "key": "2024021001531572000_r13a",
      "doi-asserted-by": "crossref",
      "first-page": "263",
      "DOI": "10.1016/0038-1098(84)90683-5",
      "volume": "51",
      "year": "1984",
      "journal-title": "Solid State Comm."
    },
    {
      "key": "2024021001531572000_r14",
      "doi-asserted-by": "crossref",
      "first-page": "299",
      "DOI": "10.1103/PhysRevB.20.299",
      "volume": "20",
      "year": "1979",
      "journal-title": "Phys. Rev. B"
    },
    {
      "key": "2024021001531572000_r15"
    },
    {
      "key": "2024021001531572000_r16"
    },
    {
      "key": "2024021001531572000_r17"
    },
    {
      "key": "2024021001531572000_r18"
    },
    {
      "key": "2024021001531572000_r19",
      "doi-asserted-by": "crossref",
      "first-page": "939",
      "DOI": "10.1103/PhysRevA.5.939",
      "volume": "5",
      "year": "1972",
      "journal-title": "Phys. Rev. A"
    },
    {
      "key": "2024021001531572000_r20",
      "doi-asserted-by": "crossref",
      "first-page": "4434",
      "DOI": "10.1063/1.447223",
      "volume": "80",
      "year": "1984",
      "journal-title": "J. Chem. Phys."
    }
  ],
  "container-title": "The Journal of Chemical Physics",
  "original-title": [],
  "language": "en",
  "link": [
    {
      "URL": "https://pubs.aip.org/aip/jcp/article-pdf/82/7/3335/18952562/3335_1_online.pdf",
      "content-type": "application/pdf",
      "content-version": "vor",
      "intended-application": "syndication"
    },
    {
      "URL": "https://pubs.aip.org/aip/jcp/article-pdf/82/7/3335/18952562/3335_1_online.pdf",
      "content-type": "unspecified",
      "content-version": "vor",
      "intended-application": "similarity-checking"
    }
  ],
  "deposited": {
    "date-parts": [
      [
        2024,
        2,
        10
      ]
    ],
    "date-time": "2024-02-10T03:07:18Z",
    "timestamp": 1707534438000
  },
  "score": 1,
  "resource": {
    "primary": {
      "URL": "https://pubs.aip.org/jcp/article/82/7/3335/790627/Consequences-of-the-balance-between-the-repulsive"
    }
  },
  "subtitle": [],
  "short-title": [],
  "issued": {
    "date-parts": [
      [
        1985,
        4,
        1
      ]
    ]
  },
  "references-count": 21,
  "journal-issue": {
    "issue": "7",
    "published-print": {
      "date-parts": [
        [
          1985,
          4,
          1
        ]
      ]
    }
  },
  "URL": "http://dx.doi.org/10.1063/1.448954",
  "relation": {},
  "ISSN": [
    "0021-9606",
    "1089-7690"
  ],
  "subject": [],
  "published-other": {
    "date-parts": [
      [
        1985,
        4,
        1
      ]
    ]
  },
  "published": {
    "date-parts": [
      [
        1985,
        4,
        1
      ]
    ]
  }
}