DC Field | Value | Language |
---|---|---|
dc.contributor.author | Huang, Huan Cong | ko |
dc.contributor.author | Yoon, Yong Jin | ko |
dc.contributor.author | Kwak, Sang Kyu | ko |
dc.date.accessioned | 2018-10-19T00:35:55Z | - |
dc.date.available | 2018-10-19T00:35:55Z | - |
dc.date.created | 2018-09-10 | - |
dc.date.created | 2018-09-10 | - |
dc.date.created | 2018-09-10 | - |
dc.date.issued | 2013-11 | - |
dc.identifier.citation | MOLECULAR PHYSICS, v.111, no.21, pp.3283 - 3288 | - |
dc.identifier.issn | 0026-8976 | - |
dc.identifier.uri | http://hdl.handle.net/10203/245982 | - |
dc.description.abstract | The equation of state and the structure of hard spheres confined in spherical pores have been investigated via molecular dynamics for different pore radii ranging from 5.0 to 10.0 sigma, where sigma is the particle diameter. The hard boundary is chosen to capture the pure geometric effect of spherical confinement. A discontinuity in the equation of state was observed, indicating the onset of a freezing-like phase transition, which was similar to that of the bulk hard-sphere fluids. The behaviour of confined particles resembles that of the bulk with increase in the pore size, while its deviation from the bulk is found to be larger at the solid-like phase. For the pore radius below 5.0, FCC-like crystal clusters are not formed in spherically confined hard spheres. | - |
dc.language | English | - |
dc.publisher | TAYLOR & FRANCIS LTD | - |
dc.subject | MONTE-CARLO CALCULATIONS | - |
dc.subject | LENNARD-JONES METHANE | - |
dc.subject | SLIT PORES | - |
dc.subject | MOLECULAR SIMULATION | - |
dc.subject | CIRCULAR CAVITIES | - |
dc.subject | CARBON NANOTUBES | - |
dc.subject | FREE-ENERGY | - |
dc.subject | FLUIDS | - |
dc.subject | SPECTROSCOPY | - |
dc.subject | BEHAVIOR | - |
dc.title | On the freezing and structure of hard spheres under spherical confinement | - |
dc.type | Article | - |
dc.identifier.wosid | 000328128600013 | - |
dc.identifier.scopusid | 2-s2.0-84887820158 | - |
dc.type.rims | ART | - |
dc.citation.volume | 111 | - |
dc.citation.issue | 21 | - |
dc.citation.beginningpage | 3283 | - |
dc.citation.endingpage | 3288 | - |
dc.citation.publicationname | MOLECULAR PHYSICS | - |
dc.identifier.doi | 10.1080/00268976.2013.781694 | - |
dc.contributor.localauthor | Yoon, Yong Jin | - |
dc.contributor.nonIdAuthor | Huang, Huan Cong | - |
dc.contributor.nonIdAuthor | Kwak, Sang Kyu | - |
dc.description.isOpenAccess | N | - |
dc.type.journalArticle | Article | - |
dc.subject.keywordAuthor | spherical pore | - |
dc.subject.keywordAuthor | confined hard spheres | - |
dc.subject.keywordAuthor | phase transition | - |
dc.subject.keywordAuthor | freezing | - |
dc.subject.keywordAuthor | molecular dynamics | - |
dc.subject.keywordAuthor | spherical pore | - |
dc.subject.keywordAuthor | confined hard spheres | - |
dc.subject.keywordAuthor | phase transition | - |
dc.subject.keywordAuthor | freezing | - |
dc.subject.keywordAuthor | molecular dynamics | - |
dc.subject.keywordPlus | MONTE-CARLO CALCULATIONS | - |
dc.subject.keywordPlus | LENNARD-JONES METHANE | - |
dc.subject.keywordPlus | SLIT PORES | - |
dc.subject.keywordPlus | MOLECULAR SIMULATION | - |
dc.subject.keywordPlus | CIRCULAR CAVITIES | - |
dc.subject.keywordPlus | CARBON NANOTUBES | - |
dc.subject.keywordPlus | FREE-ENERGY | - |
dc.subject.keywordPlus | FLUIDS | - |
dc.subject.keywordPlus | SPECTROSCOPY | - |
dc.subject.keywordPlus | BEHAVIOR | - |
dc.subject.keywordPlus | MONTE-CARLO CALCULATIONS | - |
dc.subject.keywordPlus | LENNARD-JONES METHANE | - |
dc.subject.keywordPlus | SLIT PORES | - |
dc.subject.keywordPlus | MOLECULAR SIMULATION | - |
dc.subject.keywordPlus | CIRCULAR CAVITIES | - |
dc.subject.keywordPlus | CARBON NANOTUBES | - |
dc.subject.keywordPlus | FREE-ENERGY | - |
dc.subject.keywordPlus | FLUIDS | - |
dc.subject.keywordPlus | SPECTROSCOPY | - |
dc.subject.keywordPlus | BEHAVIOR | - |
Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.