Understanding the role of silane pretreatments in an organic coating system. Part 2: a study of molecular dynamics simulation View Full Text


Ontology type: schema:ScholarlyArticle     


Article Info

DATE

2019-04-02

AUTHORS

Xiao-Xin Wang, Hong-Li Fu, Mei-Yan Jiang, Ying-Chun Liu, Ji-Ming Hu

ABSTRACT

In the second part of this work, silane-pretreated epoxy coatings on aluminum substrate are theoretically studied by molecular dynamics simulation. The results show that (3-glycidoxypropyl)-trimethoxysilane (GPTMS) provides improved interaction energy for aluminum and epoxy interface and thus ensures satisfactory adhesion. Water diffuses fastest and slowest across the interface of bis-1,2-(triethoxysilyl)ethane (BTSE)- and GPTMS-pretreated painting systems, respectively, suggesting that BTSE has the worst and GPTMS provides the best capability for constructing a reliable interface among the selected painting systems. The existence of both silane pretreatments improves the resistance of structure relaxation of the epoxy polymer chain to water penetration. More... »

PAGES

971-981

Identifiers

URI

http://scigraph.springernature.com/pub.10.1007/s11998-019-00183-9

DOI

http://dx.doi.org/10.1007/s11998-019-00183-9

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1113199871


Indexing Status Check whether this publication has been indexed by Scopus and Web Of Science using the SN Indexing Status Tool
Incoming Citations Browse incoming citations for this publication using opencitations.net

JSON-LD is the canonical representation for SciGraph data.

TIP: You can open this SciGraph record using an external JSON-LD service: JSON-LD Playground Google SDTT

[
  {
    "@context": "https://springernature.github.io/scigraph/jsonld/sgcontext.json", 
    "about": [
      {
        "id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/09", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Engineering", 
        "type": "DefinedTerm"
      }, 
      {
        "id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/0912", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Materials Engineering", 
        "type": "DefinedTerm"
      }
    ], 
    "author": [
      {
        "affiliation": {
          "alternateName": "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China", 
          "id": "http://www.grid.ac/institutes/grid.13402.34", 
          "name": [
            "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Wang", 
        "givenName": "Xiao-Xin", 
        "id": "sg:person.011764114213.90", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.011764114213.90"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China", 
          "id": "http://www.grid.ac/institutes/grid.13402.34", 
          "name": [
            "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Fu", 
        "givenName": "Hong-Li", 
        "id": "sg:person.013357055213.48", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013357055213.48"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "College of Materials Science and Engineering, Zhejiang University of Technology, 310014, Hangzhou, China", 
          "id": "http://www.grid.ac/institutes/grid.469325.f", 
          "name": [
            "College of Materials Science and Engineering, Zhejiang University of Technology, 310014, Hangzhou, China"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Jiang", 
        "givenName": "Mei-Yan", 
        "id": "sg:person.010014655215.88", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.010014655215.88"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China", 
          "id": "http://www.grid.ac/institutes/grid.13402.34", 
          "name": [
            "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Liu", 
        "givenName": "Ying-Chun", 
        "id": "sg:person.013626011205.55", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013626011205.55"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China", 
          "id": "http://www.grid.ac/institutes/grid.13402.34", 
          "name": [
            "Department of Chemistry, Zhejiang University, 310027, Hangzhou, China"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Hu", 
        "givenName": "Ji-Ming", 
        "id": "sg:person.07373005215.38", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.07373005215.38"
        ], 
        "type": "Person"
      }
    ], 
    "datePublished": "2019-04-02", 
    "datePublishedReg": "2019-04-02", 
    "description": "In the second part of this work, silane-pretreated epoxy coatings on aluminum substrate are theoretically studied by molecular dynamics simulation. The results show that (3-glycidoxypropyl)-trimethoxysilane (GPTMS) provides improved interaction energy for aluminum and epoxy interface and thus ensures satisfactory adhesion. Water diffuses fastest and slowest across the interface of bis-1,2-(triethoxysilyl)ethane (BTSE)- and GPTMS-pretreated painting systems, respectively, suggesting that BTSE has the worst and GPTMS provides the best capability for constructing a reliable interface among the selected painting systems. The existence of both silane pretreatments improves the resistance of structure relaxation of the\u00a0epoxy polymer chain to water penetration.", 
    "genre": "article", 
    "id": "sg:pub.10.1007/s11998-019-00183-9", 
    "inLanguage": "en", 
    "isAccessibleForFree": false, 
    "isFundedItemOf": [
      {
        "id": "sg:grant.8271896", 
        "type": "MonetaryGrant"
      }, 
      {
        "id": "sg:grant.8252662", 
        "type": "MonetaryGrant"
      }
    ], 
    "isPartOf": [
      {
        "id": "sg:journal.1381357", 
        "issn": [
          "1945-9645", 
          "1935-3804"
        ], 
        "name": "Journal of Coatings Technology and Research", 
        "publisher": "Springer Nature", 
        "type": "Periodical"
      }, 
      {
        "issueNumber": "4", 
        "type": "PublicationIssue"
      }, 
      {
        "type": "PublicationVolume", 
        "volumeNumber": "16"
      }
    ], 
    "keywords": [
      "molecular dynamics simulations", 
      "dynamics simulations", 
      "epoxy polymer chains", 
      "organic coating systems", 
      "silane pretreatment", 
      "polymer chains", 
      "interface of Bi", 
      "epoxy coatings", 
      "interaction energy", 
      "aluminum substrate", 
      "coating system", 
      "structure relaxation", 
      "GPTMS", 
      "painting system", 
      "water penetration", 
      "water diffuses", 
      "epoxy interface", 
      "BTSE", 
      "satisfactory adhesion", 
      "reliable interface", 
      "trimethoxysilane", 
      "good capability", 
      "coatings", 
      "interface", 
      "simulations", 
      "Bi", 
      "chain", 
      "substrate", 
      "aluminum", 
      "diffuses", 
      "system", 
      "energy", 
      "adhesion", 
      "second part", 
      "relaxation", 
      "penetration", 
      "capability", 
      "pretreatment", 
      "resistance", 
      "work", 
      "results", 
      "existence", 
      "part", 
      "study", 
      "role", 
      "improved interaction energy"
    ], 
    "name": "Understanding the role of silane pretreatments in an organic coating system. Part 2: a study of molecular dynamics simulation", 
    "pagination": "971-981", 
    "productId": [
      {
        "name": "dimensions_id", 
        "type": "PropertyValue", 
        "value": [
          "pub.1113199871"
        ]
      }, 
      {
        "name": "doi", 
        "type": "PropertyValue", 
        "value": [
          "10.1007/s11998-019-00183-9"
        ]
      }
    ], 
    "sameAs": [
      "https://doi.org/10.1007/s11998-019-00183-9", 
      "https://app.dimensions.ai/details/publication/pub.1113199871"
    ], 
    "sdDataset": "articles", 
    "sdDatePublished": "2021-12-01T19:45", 
    "sdLicense": "https://scigraph.springernature.com/explorer/license/", 
    "sdPublisher": {
      "name": "Springer Nature - SN SciGraph project", 
      "type": "Organization"
    }, 
    "sdSource": "s3://com-springernature-scigraph/baseset/20211201/entities/gbq_results/article/article_812.jsonl", 
    "type": "ScholarlyArticle", 
    "url": "https://doi.org/10.1007/s11998-019-00183-9"
  }
]
 

Download the RDF metadata as:  json-ld nt turtle xml License info

HOW TO GET THIS DATA PROGRAMMATICALLY:

JSON-LD is a popular format for linked data which is fully compatible with JSON.

curl -H 'Accept: application/ld+json' 'https://scigraph.springernature.com/pub.10.1007/s11998-019-00183-9'

N-Triples is a line-based linked data format ideal for batch operations.

curl -H 'Accept: application/n-triples' 'https://scigraph.springernature.com/pub.10.1007/s11998-019-00183-9'

Turtle is a human-readable linked data format.

curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1007/s11998-019-00183-9'

RDF/XML is a standard XML format for linked data.

curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1007/s11998-019-00183-9'


 

This table displays all metadata directly associated to this object as RDF triples.

139 TRIPLES      21 PREDICATES      71 URIs      63 LITERALS      6 BLANK NODES

Subject Predicate Object
1 sg:pub.10.1007/s11998-019-00183-9 schema:about anzsrc-for:09
2 anzsrc-for:0912
3 schema:author N4e99139209124e55a31ee37dc8a3bb3c
4 schema:datePublished 2019-04-02
5 schema:datePublishedReg 2019-04-02
6 schema:description In the second part of this work, silane-pretreated epoxy coatings on aluminum substrate are theoretically studied by molecular dynamics simulation. The results show that (3-glycidoxypropyl)-trimethoxysilane (GPTMS) provides improved interaction energy for aluminum and epoxy interface and thus ensures satisfactory adhesion. Water diffuses fastest and slowest across the interface of bis-1,2-(triethoxysilyl)ethane (BTSE)- and GPTMS-pretreated painting systems, respectively, suggesting that BTSE has the worst and GPTMS provides the best capability for constructing a reliable interface among the selected painting systems. The existence of both silane pretreatments improves the resistance of structure relaxation of the epoxy polymer chain to water penetration.
7 schema:genre article
8 schema:inLanguage en
9 schema:isAccessibleForFree false
10 schema:isPartOf N1f44457c81984ceea45f2a3e7ebbf7f1
11 N61353c90d2c7419eb2ef242c1ec26461
12 sg:journal.1381357
13 schema:keywords BTSE
14 Bi
15 GPTMS
16 adhesion
17 aluminum
18 aluminum substrate
19 capability
20 chain
21 coating system
22 coatings
23 diffuses
24 dynamics simulations
25 energy
26 epoxy coatings
27 epoxy interface
28 epoxy polymer chains
29 existence
30 good capability
31 improved interaction energy
32 interaction energy
33 interface
34 interface of Bi
35 molecular dynamics simulations
36 organic coating systems
37 painting system
38 part
39 penetration
40 polymer chains
41 pretreatment
42 relaxation
43 reliable interface
44 resistance
45 results
46 role
47 satisfactory adhesion
48 second part
49 silane pretreatment
50 simulations
51 structure relaxation
52 study
53 substrate
54 system
55 trimethoxysilane
56 water diffuses
57 water penetration
58 work
59 schema:name Understanding the role of silane pretreatments in an organic coating system. Part 2: a study of molecular dynamics simulation
60 schema:pagination 971-981
61 schema:productId N067e4a5891a6400cabb807908f35c6a6
62 N50bcd5e061f2407daf0252d5067d1673
63 schema:sameAs https://app.dimensions.ai/details/publication/pub.1113199871
64 https://doi.org/10.1007/s11998-019-00183-9
65 schema:sdDatePublished 2021-12-01T19:45
66 schema:sdLicense https://scigraph.springernature.com/explorer/license/
67 schema:sdPublisher N321d2bcb2d834fd899e3c030dd3a714b
68 schema:url https://doi.org/10.1007/s11998-019-00183-9
69 sgo:license sg:explorer/license/
70 sgo:sdDataset articles
71 rdf:type schema:ScholarlyArticle
72 N067e4a5891a6400cabb807908f35c6a6 schema:name doi
73 schema:value 10.1007/s11998-019-00183-9
74 rdf:type schema:PropertyValue
75 N1f44457c81984ceea45f2a3e7ebbf7f1 schema:issueNumber 4
76 rdf:type schema:PublicationIssue
77 N321d2bcb2d834fd899e3c030dd3a714b schema:name Springer Nature - SN SciGraph project
78 rdf:type schema:Organization
79 N4e99139209124e55a31ee37dc8a3bb3c rdf:first sg:person.011764114213.90
80 rdf:rest Nd972b6b84be94cd499f7f58c75a83f02
81 N50bcd5e061f2407daf0252d5067d1673 schema:name dimensions_id
82 schema:value pub.1113199871
83 rdf:type schema:PropertyValue
84 N61353c90d2c7419eb2ef242c1ec26461 schema:volumeNumber 16
85 rdf:type schema:PublicationVolume
86 Na74701c1c6194246b9f8595c76ef0aef rdf:first sg:person.013626011205.55
87 rdf:rest Nabc2258ce5a74324b60c3b03badcd931
88 Nabc2258ce5a74324b60c3b03badcd931 rdf:first sg:person.07373005215.38
89 rdf:rest rdf:nil
90 Nd972b6b84be94cd499f7f58c75a83f02 rdf:first sg:person.013357055213.48
91 rdf:rest Nda2cf0bae5e9469480b58151fbba792b
92 Nda2cf0bae5e9469480b58151fbba792b rdf:first sg:person.010014655215.88
93 rdf:rest Na74701c1c6194246b9f8595c76ef0aef
94 anzsrc-for:09 schema:inDefinedTermSet anzsrc-for:
95 schema:name Engineering
96 rdf:type schema:DefinedTerm
97 anzsrc-for:0912 schema:inDefinedTermSet anzsrc-for:
98 schema:name Materials Engineering
99 rdf:type schema:DefinedTerm
100 sg:grant.8252662 http://pending.schema.org/fundedItem sg:pub.10.1007/s11998-019-00183-9
101 rdf:type schema:MonetaryGrant
102 sg:grant.8271896 http://pending.schema.org/fundedItem sg:pub.10.1007/s11998-019-00183-9
103 rdf:type schema:MonetaryGrant
104 sg:journal.1381357 schema:issn 1935-3804
105 1945-9645
106 schema:name Journal of Coatings Technology and Research
107 schema:publisher Springer Nature
108 rdf:type schema:Periodical
109 sg:person.010014655215.88 schema:affiliation grid-institutes:grid.469325.f
110 schema:familyName Jiang
111 schema:givenName Mei-Yan
112 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.010014655215.88
113 rdf:type schema:Person
114 sg:person.011764114213.90 schema:affiliation grid-institutes:grid.13402.34
115 schema:familyName Wang
116 schema:givenName Xiao-Xin
117 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.011764114213.90
118 rdf:type schema:Person
119 sg:person.013357055213.48 schema:affiliation grid-institutes:grid.13402.34
120 schema:familyName Fu
121 schema:givenName Hong-Li
122 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013357055213.48
123 rdf:type schema:Person
124 sg:person.013626011205.55 schema:affiliation grid-institutes:grid.13402.34
125 schema:familyName Liu
126 schema:givenName Ying-Chun
127 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013626011205.55
128 rdf:type schema:Person
129 sg:person.07373005215.38 schema:affiliation grid-institutes:grid.13402.34
130 schema:familyName Hu
131 schema:givenName Ji-Ming
132 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.07373005215.38
133 rdf:type schema:Person
134 grid-institutes:grid.13402.34 schema:alternateName Department of Chemistry, Zhejiang University, 310027, Hangzhou, China
135 schema:name Department of Chemistry, Zhejiang University, 310027, Hangzhou, China
136 rdf:type schema:Organization
137 grid-institutes:grid.469325.f schema:alternateName College of Materials Science and Engineering, Zhejiang University of Technology, 310014, Hangzhou, China
138 schema:name College of Materials Science and Engineering, Zhejiang University of Technology, 310014, Hangzhou, China
139 rdf:type schema:Organization
 




Preview window. Press ESC to close (or click here)


...