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Statements

Subject Item
n2:RIV%2F68407700%3A21340%2F13%3A00207487%21RIV14-MSM-21340___
rdf:type
skos:Concept n16:Vysledek
dcterms:description
We develop a new algorithm for the calculation of phase splitting at constant volume, temperature, and moles. The method is based on the direct minimization of the total Helmholtz free energy of the mixture with respect to the mole- and volume-balance constraints. The algorithm uses the Newton–Raphson minimization method with line-search and modified Cholesky factorization of the Hessian to produce a sequence of states with decreasing values of the total Helmholtz free energy. The algorithm is initialized using an initial guess that is constructed using the results of the constant volume stability testing.The speed and robustness of the algorithm are demonstrated by a number of examples of two-phase equilibrium calculations. We develop a new algorithm for the calculation of phase splitting at constant volume, temperature, and moles. The method is based on the direct minimization of the total Helmholtz free energy of the mixture with respect to the mole- and volume-balance constraints. The algorithm uses the Newton–Raphson minimization method with line-search and modified Cholesky factorization of the Hessian to produce a sequence of states with decreasing values of the total Helmholtz free energy. The algorithm is initialized using an initial guess that is constructed using the results of the constant volume stability testing.The speed and robustness of the algorithm are demonstrated by a number of examples of two-phase equilibrium calculations.
dcterms:title
Fast and Robust Algorithm for Calculation of Two-Phase Equilibria at Given Volume, Temperature, and Moles Fast and Robust Algorithm for Calculation of Two-Phase Equilibria at Given Volume, Temperature, and Moles
skos:prefLabel
Fast and Robust Algorithm for Calculation of Two-Phase Equilibria at Given Volume, Temperature, and Moles Fast and Robust Algorithm for Calculation of Two-Phase Equilibria at Given Volume, Temperature, and Moles
skos:notation
RIV/68407700:21340/13:00207487!RIV14-MSM-21340___
n16:predkladatel
n21:orjk%3A21340
n3:aktivita
n9:S n9:P n9:Z
n3:aktivity
P(GAP105/11/1507), P(LH12064), S, Z(MSM6840770010)
n3:cisloPeriodika
September
n3:dodaniDat
n20:2014
n3:domaciTvurceVysledku
n15:9074856 n15:4817400
n3:druhVysledku
n11:J
n3:duvernostUdaju
n13:S
n3:entitaPredkladatele
n18:predkladatel
n3:idSjednocenehoVysledku
74696
n3:idVysledku
RIV/68407700:21340/13:00207487
n3:jazykVysledku
n5:eng
n3:klicovaSlova
Two-phase equilibrium; Constant volume flash; Helmholtz free energy minimization; Newton–Raphson method; Modified Cholesky factorization
n3:klicoveSlovo
n4:Constant%20volume%20flash n4:Modified%20Cholesky%20factorization n4:Two-phase%20equilibrium n4:Newton%E2%80%93Raphson%20method n4:Helmholtz%20free%20energy%20minimization
n3:kodStatuVydavatele
NL - Nizozemsko
n3:kontrolniKodProRIV
[813EB17F3D64]
n3:nazevZdroje
Fluid Phase Equilibria
n3:obor
n19:BJ
n3:pocetDomacichTvurcuVysledku
2
n3:pocetTvurcuVysledku
2
n3:projekt
n10:GAP105%2F11%2F1507 n10:LH12064
n3:rokUplatneniVysledku
n20:2013
n3:svazekPeriodika
353
n3:tvurceVysledku
Mikyška, Jiří Jindrová, Tereza
n3:wos
000323460500013
n3:zamer
n7:MSM6840770010
s:issn
0378-3812
s:numberOfPages
14
n6:doi
10.1016/j.fluid.2013.05.036
n17:organizacniJednotka
21340