270 related articles for article (PubMed ID: 22587084)
1. Self-diffusivity and interdiffusivity of molten aluminum-copper alloys under pressure, derived from molecular dynamics.
Rudd RE; Cabot WH; Caspersen KJ; Greenough JA; Richards DF; Streitz FH; Miller PL
Phys Rev E Stat Nonlin Soft Matter Phys; 2012 Mar; 85(3 Pt 1):031202. PubMed ID: 22587084
[TBL] [Abstract][Full Text] [Related]
2. Multicomponent diffusion in molten LiCl-KCl: dynamical correlations and divergent Maxwell-Stefan diffusivities.
Chakraborty B; Wang J; Eapen J
Phys Rev E Stat Nonlin Soft Matter Phys; 2013 May; 87(5):052312. PubMed ID: 23767545
[TBL] [Abstract][Full Text] [Related]
3. Maxwell-Stefan diffusivities in binary mixtures of ionic liquids with dimethyl sulfoxide (DMSO) and H2O.
Liu X; Vlugt TJ; Bardow A
J Phys Chem B; 2011 Jul; 115(26):8506-17. PubMed ID: 21627315
[TBL] [Abstract][Full Text] [Related]
4. Finite-Size Effects of Binary Mutual Diffusion Coefficients from Molecular Dynamics.
Jamali SH; Wolff L; Becker TM; Bardow A; Vlugt TJH; Moultos OA
J Chem Theory Comput; 2018 May; 14(5):2667-2677. PubMed ID: 29664633
[TBL] [Abstract][Full Text] [Related]
5. Mutual and Self-Diffusivities in Binary Mixtures of [EMIM][B(CN)4] with Dissolved Gases by Using Dynamic Light Scattering and Molecular Dynamics Simulations.
Koller TM; Heller A; Rausch MH; Wasserscheid P; Economou IG; Fröba AP
J Phys Chem B; 2015 Jul; 119(27):8583-92. PubMed ID: 26075680
[TBL] [Abstract][Full Text] [Related]
6. Interdiffusion in liquid Al-Cu and Ni-Cu alloys.
Cheng H; Lü YJ; Chen M
J Chem Phys; 2009 Jul; 131(4):044502. PubMed ID: 19655889
[TBL] [Abstract][Full Text] [Related]
7. Sign Crossover in All Maxwell-Stefan Diffusivities for Molten Salt LiF-BeF2: A Molecular Dynamics Study.
Chakraborty B
J Phys Chem B; 2015 Aug; 119(33):10652-63. PubMed ID: 26192629
[TBL] [Abstract][Full Text] [Related]
8. Mutual diffusion in a binary isotopic mixture.
Sharma R; Tankeshwar K
J Phys Condens Matter; 2010 Nov; 22(45):455101. PubMed ID: 21339621
[TBL] [Abstract][Full Text] [Related]
9. Thermal, Mutual, and Self-Diffusivities of Binary Liquid Mixtures Consisting of Gases Dissolved in n-Alkanes at Infinite Dilution.
Giraudet C; Klein T; Zhao G; Rausch MH; Koller TM; Fröba AP
J Phys Chem B; 2018 Mar; 122(12):3163-3175. PubMed ID: 29485876
[TBL] [Abstract][Full Text] [Related]
10. Generalized Rosenfeld scalings for tracer diffusivities in not-so-simple fluids: mixtures and soft particles.
Krekelberg WP; Pond MJ; Goel G; Shen VK; Errington JR; Truskett TM
Phys Rev E Stat Nonlin Soft Matter Phys; 2009 Dec; 80(6 Pt 1):061205. PubMed ID: 20365159
[TBL] [Abstract][Full Text] [Related]
11. Quantitative phase-field modeling of nonisothermal solidification in dilute multicomponent alloys with arbitrary diffusivities.
Ohno M
Phys Rev E Stat Nonlin Soft Matter Phys; 2012 Nov; 86(5 Pt 1):051603. PubMed ID: 23214789
[TBL] [Abstract][Full Text] [Related]
12. Mixture diffusion in nanoporous adsorbents: equivalence of Fickian and Maxwell-Stefan approaches.
Wang Y; LeVan MD
J Phys Chem B; 2008 Jul; 112(29):8600-4. PubMed ID: 18582007
[TBL] [Abstract][Full Text] [Related]
13. Diffusion and separation of CO2 and CH4 in silicalite, C168 schwarzite, and IRMOF-1: a comparative study from molecular dynamics simulation.
Babarao R; Jiang J
Langmuir; 2008 May; 24(10):5474-84. PubMed ID: 18433152
[TBL] [Abstract][Full Text] [Related]
14. Hydrogen bonding effects in adsorption of water-alcohol mixtures in zeolites and the consequences for the characteristics of the Maxwell-Stefan diffusivities.
Krishna R; van Baten JM
Langmuir; 2010 Jul; 26(13):10854-67. PubMed ID: 20411951
[TBL] [Abstract][Full Text] [Related]
15. Generalized Form for Finite-Size Corrections in Mutual Diffusion Coefficients of Multicomponent Mixtures Obtained from Equilibrium Molecular Dynamics Simulation.
Jamali SH; Bardow A; Vlugt TJH; Moultos OA
J Chem Theory Comput; 2020 Jun; 16(6):3799-3806. PubMed ID: 32338889
[TBL] [Abstract][Full Text] [Related]
16. Molecular simulation of diffusion of hydrogen, carbon monoxide, and water in heavy n-alkanes.
Makrodimitri ZA; Unruh DJ; Economou IG
J Phys Chem B; 2011 Feb; 115(6):1429-39. PubMed ID: 21254768
[TBL] [Abstract][Full Text] [Related]
17. Fick diffusion coefficients of liquid mixtures directly obtained from equilibrium molecular dynamics.
Liu X; Schnell SK; Simon JM; Bedeaux D; Kjelstrup S; Bardow A; Vlugt TJ
J Phys Chem B; 2011 Nov; 115(44):12921-9. PubMed ID: 21954841
[TBL] [Abstract][Full Text] [Related]
18. Diffusion in binary gas mixtures studied by NMR of hyperpolarized gases and molecular dynamics simulations.
Acosta RH; Agulles-Pedrós L; Komin S; Sebastiani D; Spiess HW; Blümler P
Phys Chem Chem Phys; 2006 Sep; 8(36):4182-8. PubMed ID: 16971986
[TBL] [Abstract][Full Text] [Related]
19. Development and validation of a ReaxFF reactive force field for Fe/Al/Ni alloys: molecular dynamics study of elastic constants, diffusion, and segregation.
Shin YK; Kwak H; Zou C; Vasenkov AV; van Duin AC
J Phys Chem A; 2012 Dec; 116(49):12163-74. PubMed ID: 23167515
[TBL] [Abstract][Full Text] [Related]
20. Nanoscale design of Ni-Al shape memory alloys.
Subramaniyan AK; Sun CT
Nanotechnology; 2009 Feb; 20(8):085703. PubMed ID: 19417464
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
