Zobrazeno 1 - 10
of 154
pro vyhledávání: '"Brian B. Laird"'
Autor:
Hasini S. Senanayake, Brian B. Laird, Ward H. Thompson, Nuong P. Nguyen, Pubudu N. Wimalasiri
Publikováno v:
The Journal of Physical Chemistry C. 125:23418-23434
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6179f5272489e272f49bea0e1c735549
https://doi.org/10.1021/acs.jpcc.1c06580
https://doi.org/10.1021/acs.jpcc.1c06580
Autor:
Xin, Zhang, Brian B, Laird, Hongtao, Liang, Wenliang, Lu, Zhiyong, Yu, Xiangming, Ma, Ya, Cheng, Yang, Yang
Publikováno v:
The Journal of chemical physics. 157(13)
The equilibrium silica liquid-liquid interface between the high-density liquid (HDL) phase and the low-density liquid (LDL) phase is examined using molecular-dynamics simulation. The structure, thermodynamics, and dynamics within the interfacial regi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::1dd8b73e22c3fde63058af77fe72f2f9
https://pubmed.ncbi.nlm.nih.gov/36208999
https://pubmed.ncbi.nlm.nih.gov/36208999
Autor:
Zeke A. Piskulich, Brian B. Laird
Publikováno v:
The Journal of Physical Chemistry B. 125:9341-9349
Carbon-dioxide (CO2)-expanded liquids, in which a significant mole fraction of CO2 is dissolved into an organic solvent, have been of significant interest, especially as catalytic support media. Because the CO2 mole fraction and density can be contro
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2dbe64e16bef5fd2b8657df237e531f8
https://doi.org/10.1021/acs.jpcb.1c05369
https://doi.org/10.1021/acs.jpcb.1c05369
Autor:
Xin Zhang, Wenliang Lu, Zun Liang, Yashen Wang, Songtai Lv, Hongtao Liang, Brian B. Laird, Yang Yang
We present a classical molecular-dynamics study of the collective dynamical properties of the coexisting liquid phase at equilibrium body-centered cubic (BCC) Fe crystal-melt interfaces. For the three interfacial orientations (100), (110), and (111),
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a9cc540f32bfc8b8be2c3608936c09fc
http://arxiv.org/abs/2207.14456
http://arxiv.org/abs/2207.14456
Publikováno v:
The Journal of Physical Chemistry B. 124:7938-7947
In this work, we examine the surface thermodynamics of a hard-disk fluid at curved hard walls using Monte Carlo (MC) simulation and a generalized scaled particle theory (gSPT). The curved walls are modeled as hard disks of varying radii
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c066bcb5839600a1b4e104ab1fb9b806
https://doi.org/10.1021/acs.jpcb.0c04124
https://doi.org/10.1021/acs.jpcb.0c04124
Publikováno v:
The Journal of Chemical Physics. 157:054702
To explore the curvature dependence of solid–fluid interfacial thermodynamics, we calculate, using Grand Canonical Monte Carlo simulation, the surface free energy for a 2 d hard-disk fluid confined in a circular hard container of radius R as a func
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b9d200087de5ccd706b15e4da23bab44
https://doi.org/10.1063/5.0099295
https://doi.org/10.1063/5.0099295
The kinetic mechanisms underlying bottom-up assembly of colloidal particles have been widely investigated in efforts to control crystallization pathways and to direct growth into targeted superstructures for applications including photonic crystals.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1409b54d995e68304e9624b6719a2003
Autor:
Brian B. Laird, Zhenxing Wang
Publikováno v:
Fluid Phase Equilibria. 462:25-30
In this work, we examine, using molecular simulation, the liquid-vapor phase equilibria and atomic-level structure of an ethylene-expanded mixture of methanol, water and hydrogen peroxide as functions of temperature and pressure. The motivation for t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4b13b01f6fa759957f372c2fd342d049
https://doi.org/10.1016/j.fluid.2018.01.010
https://doi.org/10.1016/j.fluid.2018.01.010
Publikováno v:
Acta Materialia. 143:329-337
We present a methodology for studying steps at faceted chemically heterogeneous solid/liquid interfaces, based on equilibrium molecular-dynamics simulations. The methodology is applied to a faceted Al(111)/Pb(liquid) interface (750 K, ambient pressur
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fd62867f31b37b6f57a8ff65ef9305c2
https://doi.org/10.1016/j.actamat.2017.09.059
https://doi.org/10.1016/j.actamat.2017.09.059
Autor:
Yang Yang, Brian B. Laird
Publikováno v:
Acta Materialia. 143:319-328
We study, using molecular-dynamics (MD) simulation, the spreading kinetics and equilibrium shape of liquid Pb droplets on an Al (111) substrate. The Al-Pb solid-liquid interface was found previously [Phys. Rev. Lett, 110, 096102 (2013)] to exhibit so
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::999999063195435d0036a06a067a95e8
https://doi.org/10.1016/j.actamat.2017.10.018
https://doi.org/10.1016/j.actamat.2017.10.018