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Statements

Subject Item
n2:RIV%2F60461373%3A22340%2F02%3A00007026%21RIV%2F2004%2FMSM%2F223404%2FN
rdf:type
skos:Concept n17:Vysledek
dcterms:description
The bridge function of the hard sphere fluid has been calculated from our new highly accurate Monte Carlo and molecular dynamics simulation data on the radial distribution function using the (inverted) Ornstein-Zernike equation. Both the systematic errors (finite size, grid size, tail) and statistical errors are analysed in detail and ways to suppress them are proposed. Uncertainties in the resulting values of B(r) are about 0.001. In contrast with many previous findings the bridge function is both positive and negative. The bridge function of the hard sphere fluid has been calculated from our new highly accurate Monte Carlo and molecular dynamics simulation data on the radial distribution function using the (inverted) Ornstein-Zernike equation. Both the systematic errors (finite size, grid size, tail) and statistical errors are analysed in detail and ways to suppress them are proposed. Uncertainties in the resulting values of B(r) are about 0.001. In contrast with many previous findings the bridge function is both positive and negative.
dcterms:title
The bridge function of hard spheres by direct inversion of computer simulation data The bridge function of hard spheres by direct inversion of computer simulation data
skos:prefLabel
The bridge function of hard spheres by direct inversion of computer simulation data The bridge function of hard spheres by direct inversion of computer simulation data
skos:notation
RIV/60461373:22340/02:00007026!RIV/2004/MSM/223404/N
n3:strany
2629-2640
n3:aktivita
n11:P
n3:aktivity
P(LN00A032)
n3:cisloPeriodika
16
n3:dodaniDat
n14:2004
n3:domaciTvurceVysledku
n7:2183544 n7:1555707 n7:9916881
n3:druhVysledku
n12:J
n3:duvernostUdaju
n15:S
n3:entitaPredkladatele
n18:predkladatel
n3:idSjednocenehoVysledku
639890
n3:idVysledku
RIV/60461373:22340/02:00007026
n3:jazykVysledku
n8:eng
n3:klicovaSlova
Hard sphere; Ornstein-Zernike equation; bridge function; molecular simulation;
n3:klicoveSlovo
n9:molecular%20simulation n9:bridge%20function n9:Ornstein-Zernike%20equation n9:Hard%20sphere
n3:kodStatuVydavatele
GB - Spojené království Velké Británie a Severního Irska
n3:kontrolniKodProRIV
[010C79381FD5]
n3:nazevZdroje
Molecular Physics
n3:obor
n6:CF
n3:pocetDomacichTvurcuVysledku
3
n3:pocetTvurcuVysledku
3
n3:pocetUcastnikuAkce
0
n3:pocetZahranicnichUcastnikuAkce
0
n3:projekt
n10:LN00A032
n3:rokUplatneniVysledku
n14:2002
n3:svazekPeriodika
100
n3:tvurceVysledku
Malijevský, Anatol Kolafa, Jiří Labík, Stanislav
s:issn
0026-8976
s:numberOfPages
12
n13:organizacniJednotka
22340