DOI: 10.1103/physrevb.52.8064. First-principles study of several hypothetical silica framework structures

First-principles study of several hypothetical silica framework structures

10.1103/physrevb.52.8064

Crossref journal-article

American Physical Society (APS)

Physical Review B (16)

Bibliography

Teter, D. M., Gibbs, G. V., Boisen, M. B., Allan, D. C., & Teter, M. P. (1995). First-principles study of several hypothetical silica framework structures. Physical Review B, 52(11), 8064â8073.

Authors 5

D. M. Teter (first)
G. V. Gibbs (additional)
M. B. Boisen (additional)
D. C. Allan (additional)
M. P. Teter (additional)

References 44 Referenced 110

10.1038/335760a0 / Nature by J. Maddox (1988)
10.1038/338291a0 / Nature by M.L. Cohen (1989)
10.1038/347243a0 / Nature by C.R.A. Catlow (1990)
10.1021/ja00044a035 / J. Am. Chem. Soc. by M.W. Deem (1992)
10.1007/BF00207206 / Phys. Chem. Min. by M.B. Boisen (1993)
10.1007/BF00202091 / Phys. Chem. Min. by M.B. Boisen (1994)
{'key': 'PhysRevB.52.8064Cc8R1', 'volume-title': 'Structure and Bonding in Crystals', 'author': 'G.V. Gibbs', 'year': '1981'} / Structure and Bonding in Crystals by G.V. Gibbs (1981)
10.1103/PhysRevLett.55.2656 / Phys. Rev. Lett. by R. Car (1985)
10.1103/PhysRevLett.59.1136 / Phys. Rev. Lett. by D.C. Allan (1987)
10.1103/PhysRevB.40.12255 / Phys. Rev. B by M.P. Teter (1989)
10.1103/RevModPhys.64.1045 / Rev. Mod. Phys. by M.C. Payne (1992)
10.1103/PhysRev.140.A1133 / Phys. Rev. by W. Kohn (1965)
10.1103/PhysRevLett.45.566 / Phys. Rev. Lett. by D.M. Ceperly (1980)
10.1103/PhysRevB.48.5031 / Phys. Rev. B by M.P. Teter (1993)
10.1103/PhysRevB.41.5414 / Phys. Rev. B by P.E. Blöchl (1990)
10.1103/PhysRevLett.48.1425 / Phys. Rev. Lett. by L. Kleinman (1982)
10.1103/PhysRevB.40.2980 / Phys. Rev. B by D.R. Hamann (1989)
10.1103/PhysRev.56.340 / Phys. Rev. by R.P. Feynman (1939)
{'key': 'PhysRevB.52.8064Cc20R1', 'first-page': '1643', 'volume': '17', 'author': 'G.P. Francis', 'year': '1990', 'journal-title': 'J. Phys. Condens. Matter'} / J. Phys. Condens. Matter by G.P. Francis (1990)
10.1029/JB083iB03p01257 / J. Geophys. Res. by F. Birch (1978)
10.1103/PhysRevB.8.5747 / Phys. Rev. B by D.J. Chadi (1973)
10.1103/PhysRevB.13.5188 / Phys. Rev. B by H.J. Monkhorst (1976)
10.1002/pssb.2221190102 / Phys. Status Solidi by R.A. Evarestov (1983)
{'key': 'PhysRevB.52.8064Cc25R1', 'first-page': '739', 'volume': '75', 'author': 'N.L. Ross', 'year': '1990', 'journal-title': 'Am. Min.'} / Am. Min. by N.L. Ross (1990)
10.1103/PhysRevB.49.12528 / Phys. Rev. B by F. Liu (1994)
{'key': 'PhysRevB.52.8064Cc27R1', 'first-page': '733', 'volume': '76', 'author': 'R.E. Cohen', 'year': '1991', 'journal-title': 'Am. Min.'} / Am. Min. by R.E. Cohen (1991)
10.1029/JB079i008p01160 / J. Geophys. Res. by L. Liu (1974)
10.1103/PhysRevB.46.1 / Phys. Rev. B by N.R. Keskar (1992)
{'key': 'PhysRevB.52.8064Cc31R1', 'first-page': '920', 'volume': '65', 'author': 'L. Levien', 'year': '1980', 'journal-title': 'Am. Min.'} / Am. Min. by L. Levien (1980)
10.1524/zkri.1992.198.3-4.177 / Z. Kristallogr. by J. Glinnemann (1992)
10.1016/0038-1098(89)90607-8 / Solid State Commun. by R.M. Hazen (1989)
10.1063/1.324517 / J. Appl. Phys. by J.D. Jorgensen (1978)
{'key': 'PhysRevB.52.8064Cc36R1', 'first-page': '9', 'volume': '79', 'author': 'R.T. Downs', 'year': '1994', 'journal-title': 'Am. Min.'} / Am. Min. by R.T. Downs (1994)
10.1063/1.356415 / J. Appl. Phys. by J.B. Parise (1994)
10.1021/j100312a052 / J. Phys. Chem. by J.W. Richardson, Jr. (1988)
10.3891/acta.chem.scand.22-3103 / Acta Chem. Scand. by S. Andersson (1968)
10.1524/zkri.1973.137.5-6.380 / Z. Kristallogr. by Y. Takeuchi (1973)
10.1107/S0567740876009308 / Acta Crystallogr. Sec. B by M. O'Keeffe (1976)
10.2475/ajs.s5-9.54.448 / Am. J. Sci. by R.W.G. Wyckoff (1925)
10.1524/zkri.1973.138.138.274 / Z. Kristallogr. by D.R. Peacor (1973)
10.1103/PhysRevLett.70.2750 / Phys. Rev. Lett. by F. Liu (1993)
10.1021/cm00036a019 / Chem. Mater. by I. Petrovic (1994)
10.1103/PhysRevB.51.8610 / Phys. Rev. B by C. Lee (1995)
10.1007/BF00202256 / Phys. Chem. Min. by N.R. Keskar (1995)

Dates

Type	When
Created	23 years ago (July 26, 2002, 8:25 p.m.)
Deposited	1 year, 7 months ago (Jan. 5, 2024, 12:22 a.m.)
Indexed	4 months ago (April 19, 2025, 4:42 p.m.)
Issued	29 years, 11 months ago (Sept. 15, 1995)
Published	29 years, 11 months ago (Sept. 15, 1995)
Published Online	29 years, 11 months ago (Sept. 15, 1995)

Funders 0

None

BibTeX

@article{Teter_1995, title={First-principles study of several hypothetical silica framework structures}, volume={52}, ISSN={1095-3795}, url={http://dx.doi.org/10.1103/physrevb.52.8064}, DOI={10.1103/physrevb.52.8064}, number={11}, journal={Physical Review B}, publisher={American Physical Society (APS)}, author={Teter, D. M. and Gibbs, G. V. and Boisen, M. B. and Allan, D. C. and Teter, M. P.}, year={1995}, month=sep, pages={8064–8073} }

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      "first-page": "1045",
      "DOI": "10.1103/RevModPhys.64.1045",
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    "date-time": "2024-01-05T05:22:59Z",
    "timestamp": 1704432179000
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  "score": 1,
  "resource": {
    "primary": {
      "URL": "https://link.aps.org/doi/10.1103/PhysRevB.52.8064"
    }
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  "subtitle": [],
  "short-title": [],
  "issued": {
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  "URL": "http://dx.doi.org/10.1103/PhysRevB.52.8064",
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  "ISSN": [
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    "1095-3795"
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  "subject": [],
  "container-title-short": "Phys. Rev. B",
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    "date-parts": [
      [
        1995,
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        15
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  }
}