Quantum-chemical investigation of methane intercalation into the interplane space of graphite-like systems View Full Text


Ontology type: schema:ScholarlyArticle     


Article Info

DATE

2012-05-24

AUTHORS

A. F. Dmitruk, O. M. Zarechnaya, I. A. Opeida

ABSTRACT

A quantum-chemical investigation is performed on the possibility of methane molecule intercalation between graphite-like planes. Ovalene dimer and its clathrates were used as models. We conclude that the existence of inclusion compounds of methane in graphite-like systems is possible. However, these compounds are endothermic, i.e., unstable. It is established that the structure with four methane molecules forms no bound supramolecular system. Clathrates with one, two, and three methane molecules may exist. The most stable of these is the clathrate with methane in the form of a dimer. More... »

PAGES

1084-1087

Identifiers

URI

http://scigraph.springernature.com/pub.10.1134/s0036024412070060

DOI

http://dx.doi.org/10.1134/s0036024412070060

DIMENSIONS

https://app.dimensions.ai/details/publication/pub.1028396437


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/2008/03", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Chemical Sciences", 
        "type": "DefinedTerm"
      }, 
      {
        "id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/0305", 
        "inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/", 
        "name": "Organic Chemistry", 
        "type": "DefinedTerm"
      }
    ], 
    "author": [
      {
        "affiliation": {
          "alternateName": "Tugan-Baranovskii Donetsk National University of Economics and Trade, 83050, Donetsk, Ukraine", 
          "id": "http://www.grid.ac/institutes/None", 
          "name": [
            "Tugan-Baranovskii Donetsk National University of Economics and Trade, 83050, Donetsk, Ukraine"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Dmitruk", 
        "givenName": "A. F.", 
        "id": "sg:person.015134672067.67", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.015134672067.67"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine", 
          "id": "http://www.grid.ac/institutes/grid.418751.e", 
          "name": [
            "Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Zarechnaya", 
        "givenName": "O. M.", 
        "id": "sg:person.012637407163.09", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.012637407163.09"
        ], 
        "type": "Person"
      }, 
      {
        "affiliation": {
          "alternateName": "Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine", 
          "id": "http://www.grid.ac/institutes/grid.418751.e", 
          "name": [
            "Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine"
          ], 
          "type": "Organization"
        }, 
        "familyName": "Opeida", 
        "givenName": "I. A.", 
        "id": "sg:person.013030143143.49", 
        "sameAs": [
          "https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013030143143.49"
        ], 
        "type": "Person"
      }
    ], 
    "datePublished": "2012-05-24", 
    "datePublishedReg": "2012-05-24", 
    "description": "A quantum-chemical investigation is performed on the possibility of methane molecule intercalation between graphite-like planes. Ovalene dimer and its clathrates were used as models. We conclude that the existence of inclusion compounds of methane in graphite-like systems is possible. However, these compounds are endothermic, i.e., unstable. It is established that the structure with four methane molecules forms no bound supramolecular system. Clathrates with one, two, and three methane molecules may exist. The most stable of these is the clathrate with methane in the form of a dimer.", 
    "genre": "article", 
    "id": "sg:pub.10.1134/s0036024412070060", 
    "isAccessibleForFree": false, 
    "isPartOf": [
      {
        "id": "sg:journal.1327871", 
        "issn": [
          "0036-0244", 
          "1531-863X"
        ], 
        "name": "Russian Journal of Physical Chemistry A", 
        "publisher": "Pleiades Publishing", 
        "type": "Periodical"
      }, 
      {
        "issueNumber": "7", 
        "type": "PublicationIssue"
      }, 
      {
        "type": "PublicationVolume", 
        "volumeNumber": "86"
      }
    ], 
    "keywords": [
      "quantum chemical investigation", 
      "supramolecular systems", 
      "inclusion compounds", 
      "interplane space", 
      "molecules form", 
      "molecule intercalation", 
      "methane molecules", 
      "clathrates", 
      "intercalation", 
      "compounds", 
      "dimers", 
      "methane", 
      "molecules", 
      "graphite-like planes", 
      "structure", 
      "investigation", 
      "form", 
      "system", 
      "plane", 
      "possibility", 
      "existence", 
      "space", 
      "model"
    ], 
    "name": "Quantum-chemical investigation of methane intercalation into the interplane space of graphite-like systems", 
    "pagination": "1084-1087", 
    "productId": [
      {
        "name": "dimensions_id", 
        "type": "PropertyValue", 
        "value": [
          "pub.1028396437"
        ]
      }, 
      {
        "name": "doi", 
        "type": "PropertyValue", 
        "value": [
          "10.1134/s0036024412070060"
        ]
      }
    ], 
    "sameAs": [
      "https://doi.org/10.1134/s0036024412070060", 
      "https://app.dimensions.ai/details/publication/pub.1028396437"
    ], 
    "sdDataset": "articles", 
    "sdDatePublished": "2022-12-01T06:30", 
    "sdLicense": "https://scigraph.springernature.com/explorer/license/", 
    "sdPublisher": {
      "name": "Springer Nature - SN SciGraph project", 
      "type": "Organization"
    }, 
    "sdSource": "s3://com-springernature-scigraph/baseset/20221201/entities/gbq_results/article/article_561.jsonl", 
    "type": "ScholarlyArticle", 
    "url": "https://doi.org/10.1134/s0036024412070060"
  }
]
 

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.10.1134/s0036024412070060'

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

curl -H 'Accept: application/n-triples' 'https://scigraph.springernature.com/pub.10.1134/s0036024412070060'

Turtle is a human-readable linked data format.

curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1134/s0036024412070060'

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

curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1134/s0036024412070060'


 

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

97 TRIPLES      20 PREDICATES      47 URIs      39 LITERALS      6 BLANK NODES

Subject Predicate Object
1 sg:pub.10.1134/s0036024412070060 schema:about anzsrc-for:03
2 anzsrc-for:0305
3 schema:author N3730e9632ff7468daa50df258ff1bedd
4 schema:datePublished 2012-05-24
5 schema:datePublishedReg 2012-05-24
6 schema:description A quantum-chemical investigation is performed on the possibility of methane molecule intercalation between graphite-like planes. Ovalene dimer and its clathrates were used as models. We conclude that the existence of inclusion compounds of methane in graphite-like systems is possible. However, these compounds are endothermic, i.e., unstable. It is established that the structure with four methane molecules forms no bound supramolecular system. Clathrates with one, two, and three methane molecules may exist. The most stable of these is the clathrate with methane in the form of a dimer.
7 schema:genre article
8 schema:isAccessibleForFree false
9 schema:isPartOf N72802784d2f745ab9bfd560ba9235aef
10 Nb3dab924df614ee9ad7d4ab17c345010
11 sg:journal.1327871
12 schema:keywords clathrates
13 compounds
14 dimers
15 existence
16 form
17 graphite-like planes
18 inclusion compounds
19 intercalation
20 interplane space
21 investigation
22 methane
23 methane molecules
24 model
25 molecule intercalation
26 molecules
27 molecules form
28 plane
29 possibility
30 quantum chemical investigation
31 space
32 structure
33 supramolecular systems
34 system
35 schema:name Quantum-chemical investigation of methane intercalation into the interplane space of graphite-like systems
36 schema:pagination 1084-1087
37 schema:productId Nd6bca405d8b84351b14b011a40a98f37
38 Ne23927fa2c9d4573a795e3040b953d5e
39 schema:sameAs https://app.dimensions.ai/details/publication/pub.1028396437
40 https://doi.org/10.1134/s0036024412070060
41 schema:sdDatePublished 2022-12-01T06:30
42 schema:sdLicense https://scigraph.springernature.com/explorer/license/
43 schema:sdPublisher N95b5341dfee145deb57caba17053a60d
44 schema:url https://doi.org/10.1134/s0036024412070060
45 sgo:license sg:explorer/license/
46 sgo:sdDataset articles
47 rdf:type schema:ScholarlyArticle
48 N3730e9632ff7468daa50df258ff1bedd rdf:first sg:person.015134672067.67
49 rdf:rest Nde705ca67f114eb0a897af2adba6ddc8
50 N72802784d2f745ab9bfd560ba9235aef schema:issueNumber 7
51 rdf:type schema:PublicationIssue
52 N76a8507bab734c2bb9bad4aa86f9eaa7 rdf:first sg:person.013030143143.49
53 rdf:rest rdf:nil
54 N95b5341dfee145deb57caba17053a60d schema:name Springer Nature - SN SciGraph project
55 rdf:type schema:Organization
56 Nb3dab924df614ee9ad7d4ab17c345010 schema:volumeNumber 86
57 rdf:type schema:PublicationVolume
58 Nd6bca405d8b84351b14b011a40a98f37 schema:name doi
59 schema:value 10.1134/s0036024412070060
60 rdf:type schema:PropertyValue
61 Nde705ca67f114eb0a897af2adba6ddc8 rdf:first sg:person.012637407163.09
62 rdf:rest N76a8507bab734c2bb9bad4aa86f9eaa7
63 Ne23927fa2c9d4573a795e3040b953d5e schema:name dimensions_id
64 schema:value pub.1028396437
65 rdf:type schema:PropertyValue
66 anzsrc-for:03 schema:inDefinedTermSet anzsrc-for:
67 schema:name Chemical Sciences
68 rdf:type schema:DefinedTerm
69 anzsrc-for:0305 schema:inDefinedTermSet anzsrc-for:
70 schema:name Organic Chemistry
71 rdf:type schema:DefinedTerm
72 sg:journal.1327871 schema:issn 0036-0244
73 1531-863X
74 schema:name Russian Journal of Physical Chemistry A
75 schema:publisher Pleiades Publishing
76 rdf:type schema:Periodical
77 sg:person.012637407163.09 schema:affiliation grid-institutes:grid.418751.e
78 schema:familyName Zarechnaya
79 schema:givenName O. M.
80 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.012637407163.09
81 rdf:type schema:Person
82 sg:person.013030143143.49 schema:affiliation grid-institutes:grid.418751.e
83 schema:familyName Opeida
84 schema:givenName I. A.
85 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.013030143143.49
86 rdf:type schema:Person
87 sg:person.015134672067.67 schema:affiliation grid-institutes:None
88 schema:familyName Dmitruk
89 schema:givenName A. F.
90 schema:sameAs https://app.dimensions.ai/discover/publication?and_facet_researcher=ur.015134672067.67
91 rdf:type schema:Person
92 grid-institutes:None schema:alternateName Tugan-Baranovskii Donetsk National University of Economics and Trade, 83050, Donetsk, Ukraine
93 schema:name Tugan-Baranovskii Donetsk National University of Economics and Trade, 83050, Donetsk, Ukraine
94 rdf:type schema:Organization
95 grid-institutes:grid.418751.e schema:alternateName Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine
96 schema:name Litvinenko Institute of Physical Organic Chemistry and Coal Chemistry, National Academy of Sciences of Ukraine, 83114, Donetsk, Ukraine
97 rdf:type schema:Organization
 




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


...