FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W4220765612> ?p ?o ?g. }

• W4220765612 endingPage "260" @default.
• W4220765612 startingPage "224" @default.
• W4220765612 abstract "Borosilicate and boroaluminosilicate glasses are important glass compositions with wide industry and technology applications. These glass compositions are also the archetypes of multicomponent boron-containing oxide glasses. However, due to their complicated structural nature and particularly boron coordination change with composition and thermal history, atomistic simulations of these glasses lag behind the more extensively studied silicate glasses. Classical and ab initio molecular dynamics simulations, on the other hand, can provide valuable information at the atomic scale thus help understand the experimental observed properties and behaviors (for example the well-known boron anomaly). In this chapter, we start with the introduction of the structure features of these glasses from experimental studies and theories based on them. Particularly, experimental determination and theoretical models that describe the fraction of four-coordinated boron ( N 4 ), one of the most important structural features in these systems, as a function of composition (e.g. the R and K values) are introduced. Classical molecular dynamics and ab initio molecular dynamics simulation methods, both of which have been used to simulate borosilicate and related glasses, are briefly discussed in terms of their advantages and limitations. This is followed by discussions of two important aspects of classical molecular dynamics simulations: the development and evaluation of the boron-related empirical potentials, and the effects of simulation details (i.e. cooling rate and system size). Applications of these new empirical potentials in simulating bulk/surface structures of borosilicate and other multicomponent boron-containing glasses including bioactive and nuclear waste glasses are presented as examples of applications of molecular dynamics (MD) simulations. A summary of B 2 O 3 and related empirical potentials with their functional forms and parameters, including a few that have been recently developed, are presented as supplemental materials of the chapter." @default.
• W4220765612 created "2022-04-03" @default.
• W4220765612 creator A5004364689 @default.
• W4220765612 creator A5039469861 @default.
• W4220765612 date "2022-04-01" @default.
• W4220765612 modified "2023-10-12" @default.
• W4220765612 title "Borosilicate and Boroaluminosilicate Glasses" @default.
• W4220765612 cites W1456246910 @default.
• W4220765612 cites W1793278740 @default.
• W4220765612 cites W1972674063 @default.
• W4220765612 cites W1975402707 @default.
• W4220765612 cites W1979523102 @default.
• W4220765612 cites W1980310511 @default.
• W4220765612 cites W1993996591 @default.
• W4220765612 cites W1995559770 @default.
• W4220765612 cites W1996776129 @default.
• W4220765612 cites W2006576711 @default.
• W4220765612 cites W2007104969 @default.
• W4220765612 cites W2012949159 @default.
• W4220765612 cites W2013361993 @default.
• W4220765612 cites W2016068413 @default.
• W4220765612 cites W2021385781 @default.
• W4220765612 cites W2025757582 @default.
• W4220765612 cites W2031184230 @default.
• W4220765612 cites W2036704806 @default.
• W4220765612 cites W2039279254 @default.
• W4220765612 cites W2041275531 @default.
• W4220765612 cites W2041932608 @default.
• W4220765612 cites W2056935224 @default.
• W4220765612 cites W2061101990 @default.
• W4220765612 cites W2065637139 @default.
• W4220765612 cites W2075545717 @default.
• W4220765612 cites W2083969019 @default.
• W4220765612 cites W2084010897 @default.
• W4220765612 cites W2084504307 @default.
• W4220765612 cites W2092391643 @default.
• W4220765612 cites W2094109729 @default.
• W4220765612 cites W2107110265 @default.
• W4220765612 cites W2114200005 @default.
• W4220765612 cites W2135762517 @default.
• W4220765612 cites W2137268018 @default.
• W4220765612 cites W2149312110 @default.
• W4220765612 cites W2161223306 @default.
• W4220765612 cites W2165119532 @default.
• W4220765612 cites W2318323409 @default.
• W4220765612 cites W2323283652 @default.
• W4220765612 cites W2327459352 @default.
• W4220765612 cites W2532418874 @default.
• W4220765612 cites W2533190337 @default.
• W4220765612 cites W2598936251 @default.
• W4220765612 cites W2753546729 @default.
• W4220765612 cites W2754920697 @default.
• W4220765612 cites W2756899833 @default.
• W4220765612 cites W2779284481 @default.
• W4220765612 cites W2782743074 @default.
• W4220765612 cites W2786271556 @default.
• W4220765612 cites W2786775383 @default.
• W4220765612 cites W2800396656 @default.
• W4220765612 cites W2892058108 @default.
• W4220765612 cites W2906506207 @default.
• W4220765612 cites W2909212123 @default.
• W4220765612 cites W2953938520 @default.
• W4220765612 cites W2955821967 @default.
• W4220765612 cites W2988475666 @default.
• W4220765612 cites W3094291806 @default.
• W4220765612 cites W3099808302 @default.
• W4220765612 cites W3103369909 @default.
• W4220765612 cites W3106238946 @default.
• W4220765612 cites W4211243352 @default.
• W4220765612 cites W4248689598 @default.
• W4220765612 cites W797813690 @default.
• W4220765612 doi "https://doi.org/10.1002/9781118939079.ch8" @default.
• W4220765612 hasPublicationYear "2022" @default.
• W4220765612 type Work @default.
• W4220765612 citedByCount "2" @default.
• W4220765612 countsByYear W42207656122023 @default.
• W4220765612 crossrefType "other" @default.
• W4220765612 hasAuthorship W4220765612A5004364689 @default.
• W4220765612 hasAuthorship W4220765612A5039469861 @default.
• W4220765612 hasConcept C121332964 @default.
• W4220765612 hasConcept C147597530 @default.
• W4220765612 hasConcept C159467904 @default.
• W4220765612 hasConcept C159985019 @default.
• W4220765612 hasConcept C178790620 @default.
• W4220765612 hasConcept C185592680 @default.
• W4220765612 hasConcept C191897082 @default.
• W4220765612 hasConcept C192562407 @default.
• W4220765612 hasConcept C206802598 @default.
• W4220765612 hasConcept C2776408459 @default.
• W4220765612 hasConcept C2781442258 @default.
• W4220765612 hasConcept C2993621735 @default.
• W4220765612 hasConcept C501308230 @default.
• W4220765612 hasConcept C59593255 @default.
• W4220765612 hasConcept C97355855 @default.
• W4220765612 hasConceptScore W4220765612C121332964 @default.
• W4220765612 hasConceptScore W4220765612C147597530 @default.
• W4220765612 hasConceptScore W4220765612C159467904 @default.
• W4220765612 hasConceptScore W4220765612C159985019 @default.

• next