Article(id=1325114500181012502, tenantId=1146029695717560320, journalId=1255847867265597444, issueId=1325114485136044925, articleNumber=null, orderNo=null, doi=null, pmid=null, cstr=null, oa=null, hot=null, price=null, onlineType=0, articleFormat=0, articleType=null, articleTypeStr=null, receivedDate=1282233600000, receivedDateStr=2010-08-20, revisedDate=1301414400000, revisedDateStr=2011-03-30, acceptedDate=null, acceptedDateStr=null, onlineDate=1793861516279, onlineDateStr=2026-11-05, pubDate=1329235200000, pubDateStr=2012-02-15, doiRegisterDate=null, doiRegisterDateStr=null, onlineIssueDate=1793861516279, onlineIssueDateStr=2026-11-05, onlineJustAcceptDate=null, onlineJustAcceptDateStr=null, onlineFirstDate=null, onlineFirstDateStr=null, sourceXml=null, magXml=null, createTime=1793861516279, creator=13701087609, updateTime=1793861516279, updator=13701087609, issue=Issue{id=1325114485136044925, tenantId=1146029695717560320, journalId=1255847867265597444, year='2012', volume='26', issue='1', pageStart='1', pageEnd='120', issueExtLink='null', onlineDate='null', pubDate='1329235200000', pubDateStr='2012-02-15', beforeIssueId=null, nextIssueId=null, price=null, status=1, issueComplete=1, articleOrder=1, issueType=-1, specialIssue=null, createTime=1793861512693, creator='13701087609', updateTime=1793861512693, updator='13701087609', preIssue=null, nextIssue=null, articleTotal=null, ext=null, issueFiles=null, downloadFileDto=null}, startPage=41, endPage=47, ext={EN=ArticleExt(id=1325114500332007447, articleId=1325114500181012502, tenantId=1146029695717560320, journalId=1255847867265597444, language=EN, title=Equation of State of Solid Neon from Quantum Calculation, columnId=null, journalTitle=Chinese Journal of High Pressure Physics, columnName=null, runingTitle=null, highlight=null, articleAbstract=

The interaction energy for fcc-neon-crystals at high pressure is calculated by Hartree-Fock method and the atomic cluster theory. The two- and three-body contributions to the static energy are also studied. Incorporating the influence of the zero-point vibration, the equations of state of fcc neon are calculated and compared with the available experimental 300 K isotherm up to the pressure of 208 GPa. It demonstrates that the calculated isotherm is in good agreement with measurements at pressures above 30 GPa. Compared with the recent predictions, the calculated results systematically improve the 300 K isotherm by 3%-5% between 100 and 210 GPa, and imply more static energy-volume relation at high pressure.

, authors=Na WU1, Chun-Ling TIAN1, Fu-Sheng LIU2, An-Nong KUANG1, Hong-Kuan YUAN1, Xing-Rong ZHENG1, authorsList=Na WU, Chun-Ling TIAN, Fu-Sheng LIU, An-Nong KUANG, Hong-Kuan YUAN, Xing-Rong ZHENG, authorCompany=null, correspAuthors=Chun-Ling TIAN, authorNote=null, correspAuthorsNote=null, copyrightStatement=null, copyrightOwner=null, extLink=null, articleAbsUrl=null, sourceXml=null, magXml=null, pdfUrl=null, pdf=null, pdfFileSize=null, pdfExtLink=null, richHtmlUrl=null, mobilePdfUrl=null, reviewReport=null, pdfFirstPage=null, abstractGraph=null, abstractGraphContent=null, abstractVideo=null, citation=null, cebUrl=null, magXmlContent=null, mapNumber=null, fund=null), CN=ArticleExt(id=1325114500587859992, articleId=1325114500181012502, tenantId=1146029695717560320, journalId=1255847867265597444, language=CN, title=固氖高压物态方程的量子理论计算, columnId=0, journalTitle=高压物理学报, columnName=, runingTitle=null, highlight=null, articleAbstract=

运用Hartree-Fock计算方法和原子团簇理论,研究了高压下面心立方晶体氖中的二体相互作用、三体相互作用对中心原子势能及冷能的贡献。结合零点振动能,计算得到了固氖在4~208 GPa压强范围内的等温物态方程。结果表明,在较高压强区域内,等温压缩线与高压实验数据符合得非常好;在压强超过100 GPa的区域内,计算得到的等温压缩线较目前已有的理论研究结果系统地改善并提高了3%~5%,精确地解释了固氖的高压实验数据。

, authors=武娜1, 田春玲1, 刘福生2, 匡安农1, 袁宏宽1, 郑兴荣1, authorsList=武娜, 田春玲, 刘福生, 匡安农, 袁宏宽, 郑兴荣, authorCompany=null, correspAuthors=田春玲, authorNote=

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

, correspAuthorsNote=
田春玲(1971-),女,博士,副教授,主要从事凝聚态物质的高压性质研究. E-mail:
, copyrightStatement=null, copyrightOwner=null, extLink=null, articleAbsUrl=null, sourceXml=Rkj5Mryu0jgK5s3ix/m8Kw==, magXml=DQZ5ynQDPZDw0r7hAMldlA==, pdfUrl=null, pdf=rcTS7Z4Bc91pXe8Q1NZiGw==, pdfFileSize=2125179, pdfExtLink=null, richHtmlUrl=null, mobilePdfUrl=null, reviewReport=null, pdfFirstPage=null, abstractGraph=null, abstractGraphContent=null, abstractVideo=null, citation=null, cebUrl=null, magXmlContent=Qxy4MZpoTdBHqTqarUN1xg==, mapNumber=null, fund=null)}, authors=[Author(id=1325114501435109408, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=0, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=wnhtt0820@163.com, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114501523189794, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501435109408, language=EN, stringName=Na WU, firstName=Na, middleName=null, lastName=WU, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114501783236643, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501435109408, language=CN, stringName=武娜, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio={"content":"

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

"}, bioImg=null, bioContent=

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114501850345509, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=1, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=tclswn@163.com, emailSecond=null, emailThird=null, correspondingAuthor=1, authorType=1, ext={EN=AuthorExt(id=1325114501921648679, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501850345509, language=EN, stringName=Chun-Ling TIAN, firstName=Chun-Ling, middleName=null, lastName=TIAN, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114501984563240, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501850345509, language=CN, stringName=田春玲, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502068449322, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=2, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502152335404, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502068449322, language=EN, stringName=Fu-Sheng LIU, firstName=Fu-Sheng, middleName=null, lastName=LIU, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=2, address=2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502232027181, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502068449322, language=CN, stringName=刘福生, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=2, address=2.西南交通大学高温高压物理研究所,四川 成都 610031, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114501317668892, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=2., ext=[AuthorCompanyExt(id=1325114501351223325, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China), AuthorCompanyExt(id=1325114501363806238, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.西南交通大学高温高压物理研究所,四川 成都 610031)])]), Author(id=1325114502294941743, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=3, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502362050609, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502294941743, language=EN, stringName=An-Nong KUANG, firstName=An-Nong, middleName=null, lastName=KUANG, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502445936690, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502294941743, language=CN, stringName=匡安农, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502513045556, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=4, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502592737334, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502513045556, language=EN, stringName=Hong-Kuan YUAN, firstName=Hong-Kuan, middleName=null, lastName=YUAN, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502664040503, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502513045556, language=CN, stringName=袁宏宽, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502747926585, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=5, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502827618363, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502747926585, language=EN, stringName=Xing-Rong ZHENG, firstName=Xing-Rong, middleName=null, lastName=ZHENG, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502915698748, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502747926585, language=CN, stringName=郑兴荣, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])])], keywords=[Keyword(id=1325114503049916477, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=EN, orderNo=1, keyword=two-body interactions), Keyword(id=1325114503117025342, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=EN, orderNo=2, keyword=three-body interactions), Keyword(id=1325114503213494335, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=EN, orderNo=3, keyword=ab initio calculation), Keyword(id=1325114503301574720, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=EN, orderNo=4, keyword=solid neon), Keyword(id=1325114503364489281, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=EN, orderNo=5, keyword=equation of state), Keyword(id=1325114503435792450, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=CN, orderNo=1, keyword=二体势), Keyword(id=1325114503515484227, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=CN, orderNo=2, keyword=三体势), Keyword(id=1325114503586787396, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=CN, orderNo=3, keyword=从头算), Keyword(id=1325114503653896261, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=CN, orderNo=4, keyword=固氖), Keyword(id=1325114503733588038, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, language=CN, orderNo=5, keyword=物态方程)], refs=[Reference(id=1325114504022995017, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[1], rfOrder=0, authorNames=null, journalName=null, refType=null, unstructuredReference=Pechenik E, Kelson I, Makov G. Many-body model of rare gases at high pressures[J]. Phys Rev B, 2008, 78(13): 134109., articleTitle=null, refAbstract=null), Reference(id=1325114504127852618, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[2], rfOrder=1, authorNames=null, journalName=null, refType=null, unstructuredReference=Schwerdtfeger P, Hermann A. Equation of state for solid neon from quantum theory[J]. Phys Rev B, 2009, 80(6): 064106., articleTitle=null, refAbstract=null), Reference(id=1325114504203350091, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[3], rfOrder=2, authorNames=null, journalName=null, refType=null, unstructuredReference=Drummond N D, Needs R J. Quantum Monte Carlo, density functional theory, and pair potential studies of solid neon[J]. Phys Rev B, 2006, 73(2): 024107., articleTitle=null, refAbstract=null), Reference(id=1325114504283041868, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[4], rfOrder=3, authorNames=null, journalName=null, refType=null, unstructuredReference=Tse J S, Klug D D, Shpakov V, et al. High pressure elastic properties of solid argon from first-principles density functional and quasi-harmonic lattice dynamic calculations[J]. Solid State Commun, 2002, 122(2): 557-560., articleTitle=null, refAbstract=null), Reference(id=1325114504404676685, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[5], rfOrder=4, authorNames=null, journalName=null, refType=null, unstructuredReference=Shao X P, Gong T L, Chen Y, et al. Spectroscopic diagnosis of the relative ionization depth with different buffer gases[J]. Acta Physica Sinica, 2010, 59(3): 1677-1680. (in Chinese), articleTitle=null, refAbstract=null), Reference(id=1325114504685695054, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[5], rfOrder=5, authorNames=null, journalName=null, refType=null, unstructuredReference=邵旭萍, 龚天林, 陈艳, 等. 不同载气下气体相对电离度的光谱诊断[J]. 物理学报, 2010, 59(3): 1677-1680., articleTitle=null, refAbstract=null), Reference(id=1325114504769581135, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[6], rfOrder=6, authorNames=null, journalName=null, refType=null, unstructuredReference=Errandonea D, Boehler R, Japel S, et al. Structural transformation of compressed solid Ar: An X-ray diffraction study to 114 GPa[J]. Phys Rev B, 2006, 73(9): 092106., articleTitle=null, refAbstract=null), Reference(id=1325114505184817232, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[7], rfOrder=7, authorNames=null, journalName=null, refType=null, unstructuredReference=Cazorla C, Errandonea D, Sola E. High-pressure phases, vibrational properties, and electronic structure of Ne(He)2 and Ar(He)2: A first-principles study[J]. Phys Rev B, 2009, 80(6): 064105., articleTitle=null, refAbstract=null), Reference(id=1325114505570693202, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[8], rfOrder=8, authorNames=null, journalName=null, refType=null, unstructuredReference=Pechenik E, Kelson I. Many-body model of rare gases at high pressures[J]. Phys Rev B, 2008, 78(13): 134109., articleTitle=null, refAbstract=null), Reference(id=1325114505952374867, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[9], rfOrder=9, authorNames=null, journalName=null, refType=null, unstructuredReference=Dewaele A, Datchi F, Loubeyre P, et al. High pressure-high temperature equations of state of neon and diamond[J]. Phys Rev B, 2008, 77(9): 094106., articleTitle=null, refAbstract=null), Reference(id=1325114506036260948, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[10], rfOrder=10, authorNames=null, journalName=null, refType=null, unstructuredReference=Aziz R A. An accurate intermolecular potential for neon[J]. High Temp High Press, 1980, 12: 565-577., articleTitle=null, refAbstract=null), Reference(id=1325114506426331221, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[11], rfOrder=11, authorNames=null, journalName=null, refType=null, unstructuredReference=Freiman Y A, Tretyak S M. Many-body interactions and high-pressure equations of state in rare-gas solids[J]. Low Temp Phys, 2007, 33(6): 545-552., articleTitle=null, refAbstract=null), Reference(id=1325114506812207190, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[12], rfOrder=12, authorNames=null, journalName=null, refType=null, unstructuredReference=Loubeyre P. Three-body-exchange interaction in dense rare gases[J]. Phys Rev B, 1987, 37(10): 5432-5439., articleTitle=null, refAbstract=null), Reference(id=1325114507210666071, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[13], rfOrder=13, authorNames=null, journalName=null, refType=null, unstructuredReference=Rosciszewski K, Paulus B, Fulde P, et al. Ab initio coupled-cluster calculations for the fcc and hcp structures of rare-gas solids[J]. Phys Rev B, 2000, 62(9): 5482-5488., articleTitle=null, refAbstract=null), Reference(id=1325114507286163544, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[14], rfOrder=14, authorNames=null, journalName=null, refType=null, unstructuredReference=Huang K, Han R Q. Solid State Physics[M]. Beijing: Higher Education Press, 1988: 137-139. (in Chinese), articleTitle=null, refAbstract=null), Reference(id=1325114507357466713, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[14], rfOrder=15, authorNames=null, journalName=null, refType=null, unstructuredReference=黄昆, 韩汝琦. 固体物理学[M]. 北京: 高等教育出版社, 1988: 137-139., articleTitle=null, refAbstract=null), Reference(id=1325114507604930650, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[15], rfOrder=16, authorNames=null, journalName=null, refType=null, unstructuredReference=Neumann M, Zoppi M. Path-integral Monte Carlo simulations of solid neon at room temperature[J]. Phys Rev B, 2000, 62(1): 41-44., articleTitle=null, refAbstract=null), Reference(id=1325114507709788251, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[16], rfOrder=17, authorNames=null, journalName=null, refType=null, unstructuredReference=Hemley R J, Zha C S, Jephcoat A P, et al. X-ray diffraction and equation of state of solid neon to 110 GPa[J]. Phys Rev B, 1989, 39(16): 11820-11827., articleTitle=null, refAbstract=null), Reference(id=1325114508032749660, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=[17], rfOrder=18, authorNames=null, journalName=null, refType=null, unstructuredReference=Finger L W, Hazen R M, Zou G, et al. Structure and compression of crystalline argon and neon at high pressure and room temperature[J]. Appl Phys Lett, 1981, 39(11): 892-894., articleTitle=null, refAbstract=null)], funds=[Fund(id=1325114503834251335, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, awardId=CSTC2009BA4005, language=CN, fundingSource=重庆市重点自然科学基金(CSTC2009BA4005), fundOrder=null, country=null), Fund(id=1325114503901360200, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, awardId=null, language=CN, fundingSource=中央高校基本科研业务费专项资金, fundOrder=null, country=null)], companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)]), AuthorCompany(id=1325114501317668892, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=2., ext=[AuthorCompanyExt(id=1325114501351223325, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China), AuthorCompanyExt(id=1325114501363806238, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.西南交通大学高温高压物理研究所,四川 成都 610031)])], figs=null, attaches=null, journal=Journal(id=1255846718311514113, delFlag=0, nameCn=高压物理学报, nameEn=Chinese Journal of High Pressure Physics, nameHistory1=null, nameHistory2=null, issn=1000-5773, eissn=null, cn=51-1147/O4, coden=null, periodic=0, language=CN, oaType=null, ccby=null, superviseOffice=null, ownerOffice=null, pubOffice=null, editorOffice=null, officeType=null, aims=null, clcCode=null, officeProv=null, officeCity=null, officeAddr=null, officeZip=null, officeEmail=null, officePhone=null, editDirector=null, officeDirector=null, officeDirectorPhone=null, officeStaffNum=null, officeEmpNum=null, coverPicUrl=KWePOcsfwWv2cMGG6VIsRw==, journalPrice=null, startedYear=null, abbrevIsoEn=Chinese Journal of High Pressure Physics, journalRemark=null, publicationField=null, createdTime=1777346790154, updatedTime=1788952099200, createdBy=18614031015, updatedBy=13041195026, firstLetterCn=G, firstLetterEn=G, subjectCode=Science, subjectName=null, subjectCodeEn=Science, subjectNameEn=null, picCn=KWePOcsfwWv2cMGG6VIsRw==, picEn=yfL33fksqTlch2QW39glNg==, jcr=null, cjcr=null, exts=[JournalExt(id=1304522912573182860, language=CN, name=高压物理学报, nameHistory1=null, nameHistory2=null, managedBy=, sponsoredBy=, publishedBy=, editorOffice=, officeProv=null, officeCity=null, officeAddr=, officeZip=, editDirector=, officeDirector=null, officePhone=null, coverPicUrl=null, journalRemark=, submitArticleUrl=null, websiteUrl=, createdTime=1788952099221, updatedTime=1788952099221, createdBy=13041195026, updatedBy=13041195026, submissionGuidelinesUrl=, submissionAuthorUrl=https://gywlxbauthor.manuscriptcloud.com/, submissionEditorUrl=https://gywlxbeditor.manuscriptcloud.com/, submissionReviewUrl=https://gywlxbauthor.manuscriptcloud.com/, submissionCeEditorUrl=, submissionAeEditorUrl=, option={"copyright":""}), JournalExt(id=1304522912619320205, language=EN, name=Chinese Journal of High Pressure Physics, nameHistory1=null, nameHistory2=null, managedBy=, sponsoredBy=, publishedBy=, editorOffice=, officeProv=null, officeCity=null, officeAddr=, officeZip=, editDirector=, officeDirector=null, officePhone=null, coverPicUrl=null, journalRemark=, submitArticleUrl=null, websiteUrl=, createdTime=1788952099232, updatedTime=1788952099232, createdBy=13041195026, updatedBy=13041195026, submissionGuidelinesUrl=, submissionAuthorUrl=https://gywlxbauthor.manuscriptcloud.com/, submissionEditorUrl=https://gywlxbeditor.manuscriptcloud.com/, submissionReviewUrl=https://gywlxbauthor.manuscriptcloud.com/, submissionCeEditorUrl=, submissionAeEditorUrl=, option={"copyright":""})], databaseList=null, tenantJournalId=1255847867265597444, websiteList=[Website(id=1255847989789208939, webName=null, webTitle=null, webDomain=null, webCopyrigh=null, webIpcNo=null, seoTitle=null, seoKeywords=null, seoDescription=null, tenantJournalId=null, journalId=1255847867265597444, journalNameCn=null, journalNameEn=null, grayFlag=null, tenantId=1146029695717560320, platformId=null, journalGroupId=null, journalGroupNameCn=null, journalGroupNameEn=null, type=1, domain=https://castjournals.cast.org.cn/joweb/gywlxb/CN, language=CN, createTime=1777347093294, createBy=18614031015, updateTime=1777347319285, updateBy=18614031015, name=高压物理学报-中文, tplId=1146099689490845704, title=高压物理学报, delFlag=0, indexPage=/home, props=[WebsiteProps(id=1255849119986364878, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=articleTextType, value=kx, createTime=1777347362753, updateTime=1777347362753, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849119952810443, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=banner, value=null, createTime=1777347362745, updateTime=1777347362745, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849120045085137, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=grayFlag, value=0, createTime=1777347362767, updateTime=1777347362767, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849119944421834, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=logo, value=https://castjournals.cast.org.cn/joweb/gywlxb/CN/file/pic?fileId=5J9nsSD+WX0mc+nIBFk2Hg==, createTime=1777347362743, updateTime=1777347362743, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849120368046547, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=minRunFlag, value=0, createTime=1777347362844, updateTime=1777347362844, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849119973781965, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=picServerUrl, value=https://castjournals.cast.org.cn/joweb/gywlxb/CN/file/pic, createTime=1777347362750, updateTime=1777347362750, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849120347075026, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=silenceFlag, value=0, createTime=1777347362839, updateTime=1777347362839, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849119965393356, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=staticResourcePath, value=https://castjournals.cast.org.cn/joweb/cast_kjdb_cn_619/, createTime=1777347362748, updateTime=1777347362748, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849120007336399, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=themeColor, value=null, createTime=1777347362758, updateTime=1777347362758, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849120019919312, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989789208939, code=themeStyle, value=null, createTime=1777347362761, updateTime=1777347362761, creator=18614031015, updator=18614031015)]), Website(id=1255847989940203908, webName=null, webTitle=null, webDomain=null, webCopyrigh=null, webIpcNo=null, seoTitle=null, seoKeywords=null, seoDescription=null, tenantJournalId=null, journalId=1255847867265597444, journalNameCn=null, journalNameEn=null, grayFlag=null, tenantId=1146029695717560320, platformId=null, journalGroupId=null, journalGroupNameCn=null, journalGroupNameEn=null, type=1, domain=https://castjournals.cast.org.cn/joweb/gywlxb/EN, language=EN, createTime=1777347093329, createBy=18614031015, updateTime=1777347316256, updateBy=18614031015, name=高压物理学报-英文, tplId=1146101810881728533, title=Chinese Journal of High Pressure Physics, delFlag=0, indexPage=/home, props=[WebsiteProps(id=1255849089909010882, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=articleTextType, value=kx, createTime=1777347355582, updateTime=1777347355582, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089871262143, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=banner, value=null, createTime=1777347355573, updateTime=1777347355573, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089934176709, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=grayFlag, value=0, createTime=1777347355588, updateTime=1777347355588, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089858679230, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=logo, value=https://castjournals.cast.org.cn/joweb/gywlxb/EN/file/pic?fileId=5J9nsSD+WX0mc+nIBFk2Hg==, createTime=1777347355570, updateTime=1777347355570, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089950953927, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=minRunFlag, value=0, createTime=1777347355592, updateTime=1777347355592, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089888039361, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=picServerUrl, value=https://castjournals.cast.org.cn/joweb/gywlxb/EN/file/pic, createTime=1777347355577, updateTime=1777347355577, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089942565318, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=silenceFlag, value=0, createTime=1777347355590, updateTime=1777347355590, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089879650752, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=staticResourcePath, value=https://castjournals.cast.org.cn/joweb/cast_kjdb_en_623/, createTime=1777347355575, updateTime=1777347355575, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089917399491, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=themeColor, value=null, createTime=1777347355584, updateTime=1777347355584, creator=18614031015, updator=18614031015), WebsiteProps(id=1255849089925788100, tenantId=1146029695717560320, journalId=null, journalGroupId=null, siteId=1255847989940203908, code=themeStyle, value=null, createTime=1777347355586, updateTime=1777347355586, creator=18614031015, updator=18614031015)])], journalTitle=高压物理学报, weixinUrl=null, journalUrl=https://www.gywlxb.cn, iacademicId=null, status=1, seqNo=null, journalTitleEn=Chinese Journal of High Pressure Physics, journalPhotoCn=KWePOcsfwWv2cMGG6VIsRw==, journalPhotoEn=yfL33fksqTlch2QW39glNg==, journalFirstLetter=G, journalRecommend=null, journalNew=null, journalCollection=null, jcrJf=null, cjcrJf=null, jcrJfStr=null, cjcrJfStr=null, submissionFirstDecision=null, sciSubjectClassification=null, casSubjectClassification=null, citeScore=null, totalCitationFrequency=null, icpCode=null, psCode=null, advertisingLicenseCode=null, copyrightInformation=null, country=null, option=, provinceCode=null, provinceName=null, collectFlag=false, interPubPlatform=, interPubPlatformUrl=null), detailUrlCn=https://castjournals.cast.org.cn/joweb/gywlxb/CN/Y2012/V26/I1/41, detailUrlEn=https://castjournals.cast.org.cn/joweb/gywlxb/EN/Y2012/V26/I1/41, pdfUrlCn=https://castjournals.cast.org.cn/joweb/gywlxb/CN/PDF/Y2012/V26/I1/41, pdfUrlEn=https://castjournals.cast.org.cn/joweb/gywlxb/EN/PDF/Y2012/V26/I1/41, aliStartDate=0, aliEndDate=0, collectionFlag=false, citedCount=null, citedUrl=null, previewStatus=0, delFlag=0, hasFullText=0, orderTime=1329235200000, fullTextJson=null, articleText=null, reference=null)
收藏切换
固氖高压物态方程的量子理论计算
收藏切换
PDF下载
武娜 1 , 田春玲 1 , 刘福生 2 , 匡安农 1 , 袁宏宽 1 , 郑兴荣 1
高压物理学报 | 2012,26(1): 41-47
收起
收藏切换
高压物理学报 | 2012 , 26 (1) : 41 -47
固氖高压物态方程的量子理论计算
全屏
[Author(id=1325114501435109408, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=0, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=wnhtt0820@163.com, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114501523189794, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501435109408, language=EN, stringName=Na WU, firstName=Na, middleName=null, lastName=WU, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114501783236643, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501435109408, language=CN, stringName=武娜, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio={"content":"

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

"}, bioImg=null, bioContent=

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114501850345509, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=1, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=tclswn@163.com, emailSecond=null, emailThird=null, correspondingAuthor=1, authorType=1, ext={EN=AuthorExt(id=1325114501921648679, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501850345509, language=EN, stringName=Chun-Ling TIAN, firstName=Chun-Ling, middleName=null, lastName=TIAN, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114501984563240, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114501850345509, language=CN, stringName=田春玲, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502068449322, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=2, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502152335404, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502068449322, language=EN, stringName=Fu-Sheng LIU, firstName=Fu-Sheng, middleName=null, lastName=LIU, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=2, address=2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502232027181, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502068449322, language=CN, stringName=刘福生, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=2, address=2.西南交通大学高温高压物理研究所,四川 成都 610031, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114501317668892, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=2., ext=[AuthorCompanyExt(id=1325114501351223325, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China), AuthorCompanyExt(id=1325114501363806238, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114501317668892, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=2.西南交通大学高温高压物理研究所,四川 成都 610031)])]), Author(id=1325114502294941743, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=3, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502362050609, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502294941743, language=EN, stringName=An-Nong KUANG, firstName=An-Nong, middleName=null, lastName=KUANG, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502445936690, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502294941743, language=CN, stringName=匡安农, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502513045556, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=4, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502592737334, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502513045556, language=EN, stringName=Hong-Kuan YUAN, firstName=Hong-Kuan, middleName=null, lastName=YUAN, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502664040503, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502513045556, language=CN, stringName=袁宏宽, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])]), Author(id=1325114502747926585, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, orderNo=5, firstName=null, middleName=null, lastName=null, nameCn=null, orcid=null, stid=null, country=null, authorPic=null, dead=0, email=null, emailSecond=null, emailThird=null, correspondingAuthor=0, authorType=1, ext={EN=AuthorExt(id=1325114502827618363, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502747926585, language=EN, stringName=Xing-Rong ZHENG, firstName=Xing-Rong, middleName=null, lastName=ZHENG, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1325114502915698748, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, authorId=1325114502747926585, language=CN, stringName=郑兴荣, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=1, address=1.西南大学物理科学与技术学院,重庆 400715, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1325114500998901785, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, xref=1., ext=[AuthorCompanyExt(id=1325114501011484698, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China), AuthorCompanyExt(id=1325114501019873307, tenantId=1146029695717560320, journalId=1255847867265597444, articleId=1325114500181012502, companyId=1325114500998901785, language=CN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=1.西南大学物理科学与技术学院,重庆 400715)])])]
武娜1 , 田春玲1 , 刘福生2, 匡安农1, 袁宏宽1, 郑兴荣1
作者信息
  • 1.西南大学物理科学与技术学院,重庆 400715
  • 2.西南交通大学高温高压物理研究所,四川 成都 610031
通讯作者:
田春玲(1971-),女,博士,副教授,主要从事凝聚态物质的高压性质研究. E-mail:
作者简介:

武娜(1987-),女,硕士研究生,主要从事固态惰性气体的高压性质研究. E-mail:

Equation of State of Solid Neon from Quantum Calculation
Na WU1 , Chun-Ling TIAN1 , Fu-Sheng LIU2, An-Nong KUANG1, Hong-Kuan YUAN1, Xing-Rong ZHENG1
Affiliations
  • 1.School of Physics Science and Technology, Southwest University, Chongqing 400715, China
  • 2.Institute of High Temperature and High Pressure Physics, Southwest Jiaotong University, Chengdu 610031, China
出版时间: 2012-02-15
文章导航
收藏切换

运用Hartree-Fock计算方法和原子团簇理论,研究了高压下面心立方晶体氖中的二体相互作用、三体相互作用对中心原子势能及冷能的贡献。结合零点振动能,计算得到了固氖在4~208 GPa压强范围内的等温物态方程。结果表明,在较高压强区域内,等温压缩线与高压实验数据符合得非常好;在压强超过100 GPa的区域内,计算得到的等温压缩线较目前已有的理论研究结果系统地改善并提高了3%~5%,精确地解释了固氖的高压实验数据。

二体势  /  三体势  /  从头算  /  固氖  /  物态方程

The interaction energy for fcc-neon-crystals at high pressure is calculated by Hartree-Fock method and the atomic cluster theory. The two- and three-body contributions to the static energy are also studied. Incorporating the influence of the zero-point vibration, the equations of state of fcc neon are calculated and compared with the available experimental 300 K isotherm up to the pressure of 208 GPa. It demonstrates that the calculated isotherm is in good agreement with measurements at pressures above 30 GPa. Compared with the recent predictions, the calculated results systematically improve the 300 K isotherm by 3%-5% between 100 and 210 GPa, and imply more static energy-volume relation at high pressure.

two-body interactions  /  three-body interactions  /  ab initio calculation  /  solid neon  /  equation of state
武娜, 田春玲, 刘福生, 匡安农, 袁宏宽, 郑兴荣. 固氖高压物态方程的量子理论计算. 高压物理学报, 2012 , 26 (1) : 41 -47 .
Na WU, Chun-Ling TIAN, Fu-Sheng LIU, An-Nong KUANG, Hong-Kuan YUAN, Xing-Rong ZHENG. Equation of State of Solid Neon from Quantum Calculation[J]. Chinese Journal of High Pressure Physics, 2012 , 26 (1) : 41 -47 .
  • 重庆市重点自然科学基金(CSTC2009BA4005)
  • 中央高校基本科研业务费专项资金
参考文献 引证文献
排序方式:
[1]
Pechenik E, Kelson I, Makov G. Many-body model of rare gases at high pressures[J]. Phys Rev B, 2008, 78(13): 134109.
[2]
Schwerdtfeger P, Hermann A. Equation of state for solid neon from quantum theory[J]. Phys Rev B, 2009, 80(6): 064106.
[3]
Drummond N D, Needs R J. Quantum Monte Carlo, density functional theory, and pair potential studies of solid neon[J]. Phys Rev B, 2006, 73(2): 024107.
[4]
Tse J S, Klug D D, Shpakov V, et al. High pressure elastic properties of solid argon from first-principles density functional and quasi-harmonic lattice dynamic calculations[J]. Solid State Commun, 2002, 122(2): 557-560.
[5]
Shao X P, Gong T L, Chen Y, et al. Spectroscopic diagnosis of the relative ionization depth with different buffer gases[J]. Acta Physica Sinica, 2010, 59(3): 1677-1680. (in Chinese)
邵旭萍, 龚天林, 陈艳, 等. 不同载气下气体相对电离度的光谱诊断[J]. 物理学报, 2010, 59(3): 1677-1680.
[6]
Errandonea D, Boehler R, Japel S, et al. Structural transformation of compressed solid Ar: An X-ray diffraction study to 114 GPa[J]. Phys Rev B, 2006, 73(9): 092106.
[7]
Cazorla C, Errandonea D, Sola E. High-pressure phases, vibrational properties, and electronic structure of Ne(He)2 and Ar(He)2: A first-principles study[J]. Phys Rev B, 2009, 80(6): 064105.
[8]
Pechenik E, Kelson I. Many-body model of rare gases at high pressures[J]. Phys Rev B, 2008, 78(13): 134109.
[9]
Dewaele A, Datchi F, Loubeyre P, et al. High pressure-high temperature equations of state of neon and diamond[J]. Phys Rev B, 2008, 77(9): 094106.
[10]
Aziz R A. An accurate intermolecular potential for neon[J]. High Temp High Press, 1980, 12: 565-577.
[11]
Freiman Y A, Tretyak S M. Many-body interactions and high-pressure equations of state in rare-gas solids[J]. Low Temp Phys, 2007, 33(6): 545-552.
[12]
Loubeyre P. Three-body-exchange interaction in dense rare gases[J]. Phys Rev B, 1987, 37(10): 5432-5439.
[13]
Rosciszewski K, Paulus B, Fulde P, et al. Ab initio coupled-cluster calculations for the fcc and hcp structures of rare-gas solids[J]. Phys Rev B, 2000, 62(9): 5482-5488.
[14]
Huang K, Han R Q. Solid State Physics[M]. Beijing: Higher Education Press, 1988: 137-139. (in Chinese)
黄昆, 韩汝琦. 固体物理学[M]. 北京: 高等教育出版社, 1988: 137-139.
[15]
Neumann M, Zoppi M. Path-integral Monte Carlo simulations of solid neon at room temperature[J]. Phys Rev B, 2000, 62(1): 41-44.
[16]
Hemley R J, Zha C S, Jephcoat A P, et al. X-ray diffraction and equation of state of solid neon to 110 GPa[J]. Phys Rev B, 1989, 39(16): 11820-11827.
[17]
Finger L W, Hazen R M, Zou G, et al. Structure and compression of crystalline argon and neon at high pressure and room temperature[J]. Appl Phys Lett, 1981, 39(11): 892-894.
2012年第26卷第1期
PDF下载
3
0
引用本文
BibTeX
文章信息
  • 接收时间:2010-08-20
  • 首发时间:2026-11-05
  • 出版时间:2012-02-15
补充材料
相关文章
文章信息
作者
出版历史
  • 收稿日期:2010-08-20
  • 修回日期:2011-03-30
基金
重庆市重点自然科学基金(CSTC2009BA4005)
中央高校基本科研业务费专项资金
作者信息
    1.西南大学物理科学与技术学院,重庆 400715
    2.西南交通大学高温高压物理研究所,四川 成都 610031

通讯作者:

田春玲(1971-),女,博士,副教授,主要从事凝聚态物质的高压性质研究. E-mail:
参考文献
分享链接
https://castjournals.cast.org.cn/joweb/gywlxb/CN/1325114500181012502
分享至
全文二维码

扫描看全文

引用本文
BibTeX
本文的引用情况
2种不同金属材料的力学参数
科
Family
属数
Number of
genus
种数
Number of
species
占总种数比例
Percentage of
total species (%)
属
Genus
种数
Number of
species
占总种数比例
Percentage of total
species (%)
鹅膏菌科Amanitaceae 2 11 5.26 鹅膏菌属 Amanita 10 4.78
小菇科 Mycenaceae 2 12 5.74 丝盖伞属 Inocybe 5 2.39
多孔菌科 Polyporaceae 8 14 6.70 蜡蘑属 Laccaria 5 2.39
红菇科 Russulaceae 3 23 11.00 小皮伞属 Marasmius 6 2.87
小菇属 Mycena 11 5.26
光柄菇属 Pluteus 5 2.39
红菇属 Russula 17 8.13
栓菌属 Trametes 5 2.39
关闭全屏