Designing 2D covalent networks with lattice Monte Carlo simulations: precursor self-assembly

2021 ◽  
Vol 23 (10) ◽  
pp. 5780-5796
Author(s):  
Jakub Lisiecki ◽  
Paweł Szabelski
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Self Assembly ◽  
Theoretical Calculations ◽  
Lattice Monte Carlo ◽  
Halogen Atoms ◽  
Multiple Outputs ◽  
Metal Organic ◽  
Organic Precursors

Theoretical calculations predicted multiple outputs of the surface-confined self-assembly of metal–organic precursors comprising naphthalene monomeric units with differently distributed halogen atoms.

scholarly journals Self-assembly of surfactants in a supercritical solvent from lattice Monte Carlo simulations

2002 ◽  
Vol 116 (3) ◽  
pp. 1171-1184 ◽  
Author(s):  
Martin Lı́sal ◽  
Carol K. Hall ◽  
Keith E. Gubbins ◽  
Athanassios Z. Panagiotopoulos
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Self Assembly ◽  
Lattice Monte Carlo ◽  
Supercritical Solvent

scholarly journals Partial deconfinement at strong coupling on the lattice

2021 ◽  
Vol 2021 (2) ◽  
Author(s):  
Hiromasa Watanabe ◽  
Georg Bergner ◽  
Norbert Bodendorfer ◽  
Shotaro Shiba Funai ◽  
Masanori Hanada ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Matrix Models ◽  
Gauge Group ◽  
Strong Coupling ◽  
Direct Evidence ◽  
Lattice Monte Carlo

Abstract We provide evidence for partial deconfinement — the deconfinement of a SU(M) subgroup of the SU(N) gauge group — by using lattice Monte Carlo simulations. We take matrix models as concrete examples. By appropriately fixing the gauge, we observe that the M × M submatrices deconfine. This gives direct evidence for partial deconfinement at strong coupling. We discuss the applications to QCD and holography.

Low-coverage adsorption properties of the metal–organic framework MIL-47 studied by pulse chromatography and Monte Carlo simulations

2009 ◽  
Vol 11 (18) ◽  
pp. 3515 ◽  
Author(s):  
Vincent Finsy ◽  
Sofia Calero ◽  
Elena García-Pérez ◽  
Patrick J. Merkling ◽  
Gill Vedts ◽  
...  
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Metal Organic Framework ◽  
Adsorption Properties ◽  
Metal Organic ◽  
Low Coverage ◽  
Organic Framework

Off‐lattice Monte Carlo simulations of polymer melts confined between two plates

1988 ◽  
Vol 89 (8) ◽  
pp. 5206-5215 ◽  
Author(s):  
Sanat K. Kumar ◽  
Michele Vacatello ◽  
Do Y. Yoon
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Polymer Melts ◽  
Lattice Monte Carlo

Screening of bio-compatible metal–organic frameworks as potential drug carriers using Monte Carlo simulations

2014 ◽  
Vol 2 (7) ◽  
pp. 766-774 ◽  
Author(s):  
María C. Bernini ◽  
David Fairen-Jimenez ◽  
Marcelo Pasinetti ◽  
Antonio J. Ramirez-Pastor ◽  
Randall Q. Snurr
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Metal Organic Frameworks ◽  
Drug Carriers ◽  
Potential Drug ◽  
Metal Organic

Lattice Monte Carlo Simulations of Chain Conformations in Polymer Nanocomposites

2005 ◽  
Vol 38 (10) ◽  
pp. 4495-4500 ◽  
Author(s):  
Murat S. Ozmusul ◽  
Catalin R. Picu ◽  
S. S. Sternstein ◽  
Sanat K. Kumar
Keyword(s):  
Monte Carlo ◽  
Monte Carlo Simulations ◽  
Polymer Nanocomposites ◽  
Lattice Monte Carlo ◽  
Chain Conformations
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