Consistency of empirical corrections of the classical nucleation theory for nucleation in steam with nucleation experiments and molecular simulations

Kód výsledku v IS VaVaI

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Výsledek na webu

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DOI - Digital Object Identifier

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Jazyk výsledku

angličtina

Název v původním jazyce

Consistency of empirical corrections of the classical nucleation theory for nucleation in steam with nucleation experiments and molecular simulations

Popis výsledku v původním jazyce

We compare experimental nucleation rates for water vapour in various carrier gases, nucleation rates deduced from empirical adjustments of the classical nucleation theory (CNT) earlier developed to reproduce pressure and optical data for condensing steam flows in converging-diverging nozzles and turbine stages, and ucleation rates obtained from molecular simulations. Results of original molecular dynamic simulations for TIP4P/2005 force field in the NVE conditions are provided. New experimental nucleation rate data sets are generated based on empirical CNT corrections by Valha and Nedbal (1980) and by Petr and Kolovratník (2011). Correction of the CNT for non-isothermal nucleation conditions is applied to experimental, simulated and the derived experimental data. The derived experimentalnnucleation rate data follow a similar temperature trend as the nucleation rate data for water vapour in carrier gases at lower temperatures. The ratio of observed nucleation rates to CNT predictions decreases more steeply with temperature than the empirical correction by Wölk et al. (2002). Ratios of nucleation rates computed from molecular simulations to CNT predictions do not show a significant temperature trend.

Název v anglickém jazyce

Consistency of empirical corrections of the classical nucleation theory for nucleation in steam with nucleation experiments and molecular simulations

Popis výsledku anglicky

We compare experimental nucleation rates for water vapour in various carrier gases, nucleation rates deduced from empirical adjustments of the classical nucleation theory (CNT) earlier developed to reproduce pressure and optical data for condensing steam flows in converging-diverging nozzles and turbine stages, and ucleation rates obtained from molecular simulations. Results of original molecular dynamic simulations for TIP4P/2005 force field in the NVE conditions are provided. New experimental nucleation rate data sets are generated based on empirical CNT corrections by Valha and Nedbal (1980) and by Petr and Kolovratník (2011). Correction of the CNT for non-isothermal nucleation conditions is applied to experimental, simulated and the derived experimental data. The derived experimentalnnucleation rate data follow a similar temperature trend as the nucleation rate data for water vapour in carrier gases at lower temperatures. The ratio of observed nucleation rates to CNT predictions decreases more steeply with temperature than the empirical correction by Wölk et al. (2002). Ratios of nucleation rates computed from molecular simulations to CNT predictions do not show a significant temperature trend.

Druh

D - Stať ve sborníku

CEP obor

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OECD FORD obor

20303 - Thermodynamics

Projekt

Výsledek vznikl pri realizaci vícero projektů. Více informací v záložce Projekty.

Návaznosti

I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Rok uplatnění

2016

Kód důvěrnosti údajů

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Název statě ve sborníku

Wet Stream Conference Prague 2016 - Proceedings

ISBN

978-80-01-5997-5

ISSN

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e-ISSN

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Počet stran výsledku

19

Strana od-do

182-200

Název nakladatele

Česke vysoké učení technické

Místo vydání

Praha

Místo konání akce

Praha

Datum konání akce

12. 9. 2016

Typ akce podle státní příslušnosti

WRD - Celosvětová akce

Kód UT WoS článku

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