schliessen

Filtern

 

Bibliotheken

Enhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field

Effects of an external transverse electric field on the adsorption and diffusion of Li atoms on the single-walled carbon nanotubes (CNTs) were investigated using density functional theory. Results showed that the adsorption energy was significantly enhanced by applying the electric field. As the ext... Full description

Journal Title: Journal of Nanoparticle Research Nov 2016, Vol.18(11), pp.1-7
Main Author: Shi, Wenwu
Other Authors: Wang, Zhiguo , Fu, Yq
Format: Electronic Article Electronic Article
Language: English
Subjects:
ID: ISSN: 13880764 ; DOI: 10.1007/s11051-016-3623-7
Link: http://search.proquest.com/docview/1837165283/?pq-origsite=primo
Zum Text:
SendSend as email Add to Book BagAdd to Book Bag
Staff View
recordid: proquest1837165283
title: Enhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field
format: Article
creator:
  • Shi, Wenwu
  • Wang, Zhiguo
  • Fu, Yq
subjects:
  • Modeling and Simulation
  • Battery
  • External Transverse Electric Field
  • Energy Barrier
  • Adsorption Energy
  • Cnts
ispartof: Journal of Nanoparticle Research, Nov 2016, Vol.18(11), pp.1-7
description: Effects of an external transverse electric field on the adsorption and diffusion of Li atoms on the single-walled carbon nanotubes (CNTs) were investigated using density functional theory. Results showed that the adsorption energy was significantly enhanced by applying the electric field. As the external electric field was increased from 0.0 to 0.6 V/Å, the adsorption energies were decreased from -1.37 to -2.31, -1.32 to -2.46, and -1.33 to -2.63 eV for the Li atoms adsorbed on (6,6), (8,8), and (10,10) CNTs, respectively. Meanwhile, the diffusion barriers of the Li atoms on the CNTs were also decreased as the external electric field was applied. When the external electric field was increased from 0.0 to 0.6 V/Å, the energy barriers were decreased from 0.42, 0.40, and 0.39 eV to 0.20, 0.17, and 0.15 eV for Li diffusion in the (6,6), (8,8), and (10,10) CNTs, respectively. The results proved that an external electric field can be applied to enhance the adsorption and diffusion of Li atoms on the CNTs (used as the anode) for lithium ion batteries.
language: eng
source:
identifier: ISSN: 13880764 ; DOI: 10.1007/s11051-016-3623-7
fulltext: fulltext
issn:
  • 13880764
  • 1388-0764
url: Link


@attributes
ID826777878
RANK0.07
NO1
SEARCH_ENGINEprimo_central_multiple_fe
SEARCH_ENGINE_TYPEPrimo Central Search Engine
LOCALfalse
PrimoNMBib
record
control
sourcerecordid1837165283
sourceidproquest
recordidTN_proquest1837165283
sourcesystemOther
pqid1837165283
galeid469539541
display
typearticle
titleEnhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field
creatorShi, Wenwu ; Wang, Zhiguo ; Fu, Yq
ispartofJournal of Nanoparticle Research, Nov 2016, Vol.18(11), pp.1-7
identifierISSN: 13880764 ; DOI: 10.1007/s11051-016-3623-7
subjectModeling and Simulation ; Battery ; External Transverse Electric Field ; Energy Barrier ; Adsorption Energy ; Cnts
descriptionEffects of an external transverse electric field on the adsorption and diffusion of Li atoms on the single-walled carbon nanotubes (CNTs) were investigated using density functional theory. Results showed that the adsorption energy was significantly enhanced by applying the electric field. As the external electric field was increased from 0.0 to 0.6 V/Å, the adsorption energies were decreased from -1.37 to -2.31, -1.32 to -2.46, and -1.33 to -2.63 eV for the Li atoms adsorbed on (6,6), (8,8), and (10,10) CNTs, respectively. Meanwhile, the diffusion barriers of the Li atoms on the CNTs were also decreased as the external electric field was applied. When the external electric field was increased from 0.0 to 0.6 V/Å, the energy barriers were decreased from 0.42, 0.40, and 0.39 eV to 0.20, 0.17, and 0.15 eV for Li diffusion in the (6,6), (8,8), and (10,10) CNTs, respectively. The results proved that an external electric field can be applied to enhance the adsorption and diffusion of Li atoms on the CNTs (used as the anode) for lithium ion batteries.
languageeng
source
version4
lds50peer_reviewed
links
openurl$$Topenurl_article
openurlfulltext$$Topenurlfull_article
backlink$$Uhttp://search.proquest.com/docview/1837165283/?pq-origsite=primo$$EView_record_in_ProQuest_(subscribers_only)
search
creatorcontrib
0Shi, Wenwu
1Wang, Zhiguo
2Fu, Yq
titleEnhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field
descriptionEffects of an external transverse electric field on the adsorption and diffusion of Li atoms on the single-walled carbon nanotubes (CNTs) were investigated using density functional theory. Results showed that the adsorption energy was significantly enhanced by applying the electric field. As the external electric field was increased from 0.0 to 0.6 V/Å, the adsorption energies were decreased from -1.37 to -2.31, -1.32 to -2.46, and -1.33 to -2.63 eV for the Li atoms adsorbed on (6,6), (8,8), and (10,10) CNTs, respectively. Meanwhile, the diffusion barriers of the Li atoms on the CNTs were also decreased as the external electric field was applied. When the external electric field was increased from 0.0 to 0.6 V/Å, the energy barriers were decreased from 0.42, 0.40, and 0.39 eV to 0.20, 0.17, and 0.15 eV for Li diffusion in the (6,6), (8,8), and (10,10) CNTs, respectively. The results proved that an external electric field can be applied to enhance the adsorption and diffusion of Li atoms on the CNTs (used as the anode) for lithium ion batteries.
subject
0Modeling and Simulation
1Battery
2External Transverse Electric Field
3Energy Barrier
4Adsorption Energy
5Cnts
6Modeling and simulation
7External transverse electric field
8Energy barrier
9Adsorption energy
10CNTs
general
0English
1Springer Science & Business Media
210.1007/s11051-016-3623-7
3Health & Medical Collection (Alumni edition)
4ProQuest Pharma Collection
5Health & Medical Collection
6Engineered Materials Abstracts
7ANTE: Abstracts in New Technology & Engineering
8Solid State and Superconductivity Abstracts
9Mechanical & Transportation Engineering Abstracts
10METADEX
11Materials Science Database
12Advanced Technologies & Aerospace Database
13Engineering Database
14Biological Science Database
15Advanced Technologies Database with Aerospace
16Engineering Research Database
17Materials Research Database
18Technology Research Database
19ProQuest Biological Science Collection
20ProQuest Central
21ProQuest Engineering Collection
22ProQuest Environmental Science Collection
23ProQuest Advanced Technologies & Aerospace Collection
24ProQuest Hospital Collection
25ProQuest Materials Science Collection
26ProQuest Natural Science Collection
27ProQuest Technology Collection
28Hospital Premium Collection (Alumni edition)
29ProQuest SciTech Collection
30ProQuest Health & Medical Complete
31Agricultural & Environmental Science Database
32Materials Science & Engineering Database
33Natural Science Collection
34ProQuest Central (new)
35SciTech Premium Collection
36Technology Collection
37Health Research Premium Collection
38Health Research Premium Collection (Alumni edition)
39ProQuest Central China
sourceidproquest
recordidproquest1837165283
issn
013880764
11388-0764
rsrctypearticle
creationdate2016
addtitleJournal of Nanoparticle Research
searchscope
01006761
11006815
21007067
31007393
41007421
51007443
61007481
71007488
81007526
91007528
101007851
111007852
121007853
131007856
141007945
151008886
161009127
171009386
1810000004
1910000005
2010000006
2110000012
2210000013
2310000014
2410000015
2510000022
2610000038
2710000039
2810000041
2910000043
3010000045
3110000047
3210000049
3310000050
3410000053
3510000118
3610000119
3710000120
3810000155
3910000156
4010000195
4110000198
4210000200
4310000201
4410000203
4510000209
4610000217
4710000233
4810000234
4910000238
5010000250
5110000253
5210000255
5310000256
5410000260
5510000265
5610000268
5710000270
5810000271
5910000300
60proquest
scope
01006761
11006815
21007067
31007393
41007421
51007443
61007481
71007488
81007526
91007528
101007851
111007852
121007853
131007856
141007945
151008886
161009127
171009386
1810000004
1910000005
2010000006
2110000012
2210000013
2310000014
2410000015
2510000022
2610000038
2710000039
2810000041
2910000043
3010000045
3110000047
3210000049
3310000050
3410000053
3510000118
3610000119
3710000120
3810000155
3910000156
4010000195
4110000198
4210000200
4310000201
4410000203
4510000209
4610000217
4710000233
4810000234
4910000238
5010000250
5110000253
5210000255
5310000256
5410000260
5510000265
5610000268
5710000270
5810000271
5910000300
60proquest
lsr43
01006761true
11006815true
21007067true
31007393false
41007421false
51007443false
61007481false
71007488false
81007526false
91007528false
101007851true
111007852true
121007853true
131007856true
141007945true
151008886true
161009127true
171009386true
1810000004false
1910000005false
2010000006false
2110000012false
2210000013false
2310000014false
2410000015false
2510000022false
2610000038true
2710000039true
2810000041true
2910000043false
3010000045true
3110000047true
3210000049true
3310000050true
3410000053true
3510000118true
3610000119true
3710000120true
3810000155true
3910000156true
4010000195false
4110000198false
4210000200false
4310000201false
4410000203false
4510000209false
4610000217false
4710000233true
4810000234false
4910000238true
5010000250true
5110000253true
5210000255true
5310000256true
5410000260true
5510000265true
5610000268true
5710000270true
5810000271true
5910000300true
startdate20161101
enddate20161101
citationpf 1 pt 7 vol 18 issue 11
lsr30VSR-Enriched:[pqid, eissn, galeid]
sort
titleEnhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field
authorShi, Wenwu ; Wang, Zhiguo ; Fu, Yq
creationdate20161101
lso0120161101
facets
frbrgroupid6164985718302851939
frbrtype5
languageeng
creationdate2016
topic
0Modeling and Simulation
1Battery
2External Transverse Electric Field
3Energy Barrier
4Adsorption Energy
5Cnts
collection
0Health & Medical Collection (Alumni edition)
1ProQuest Pharma Collection
2Health & Medical Collection
3Engineered Materials Abstracts
4ANTE: Abstracts in New Technology & Engineering
5Solid State and Superconductivity Abstracts
6Mechanical & Transportation Engineering Abstracts
7METADEX
8Materials Science Database
9Advanced Technologies & Aerospace Database
10Engineering Database
11Biological Science Database
12Advanced Technologies Database with Aerospace
13Engineering Research Database
14Materials Research Database
15Technology Research Database
16ProQuest Biological Science Collection
17ProQuest Central
18ProQuest Engineering Collection
19ProQuest Environmental Science Collection
20ProQuest Advanced Technologies & Aerospace Collection
21ProQuest Hospital Collection
22ProQuest Materials Science Collection
23ProQuest Natural Science Collection
24ProQuest Technology Collection
25Hospital Premium Collection (Alumni edition)
26ProQuest SciTech Collection
27ProQuest Health & Medical Complete
28Agricultural & Environmental Science Database
29Materials Science & Engineering Database
30Natural Science Collection
31ProQuest Central (new)
32SciTech Premium Collection
33Technology Collection
34Health Research Premium Collection
35Health Research Premium Collection (Alumni edition)
36ProQuest Central China
prefilterarticles
rsrctypearticles
creatorcontrib
0Shi, Wenwu
1Wang, Zhiguo
2Fu, Yq
jtitleJournal of Nanoparticle Research
toplevelpeer_reviewed
delivery
delcategoryRemote Search Resource
fulltextfulltext
addata
aulast
0Shi
1Wang
2Fu
aufirst
0Wenwu
1Zhiguo
2Yq
auinit1
0W.
1Z.
2Y.
au
0Shi, Wenwu
1Wang, Zhiguo
2Fu, Yq
atitleEnhancement of adsorption and diffusion of lithium in single-walled carbon nanotubes by external electric field
jtitleJournal of Nanoparticle Research
risdate20161101
volume18
issue11
spage1
epage7
pages1-7
issn13880764
formatjournal
genrearticle
ristypeJOUR
abstractEffects of an external transverse electric field on the adsorption and diffusion of Li atoms on the single-walled carbon nanotubes (CNTs) were investigated using density functional theory. Results showed that the adsorption energy was significantly enhanced by applying the electric field. As the external electric field was increased from 0.0 to 0.6 V/Å, the adsorption energies were decreased from -1.37 to -2.31, -1.32 to -2.46, and -1.33 to -2.63 eV for the Li atoms adsorbed on (6,6), (8,8), and (10,10) CNTs, respectively. Meanwhile, the diffusion barriers of the Li atoms on the CNTs were also decreased as the external electric field was applied. When the external electric field was increased from 0.0 to 0.6 V/Å, the energy barriers were decreased from 0.42, 0.40, and 0.39 eV to 0.20, 0.17, and 0.15 eV for Li diffusion in the (6,6), (8,8), and (10,10) CNTs, respectively. The results proved that an external electric field can be applied to enhance the adsorption and diffusion of Li atoms on the CNTs (used as the anode) for lithium ion batteries.
copDordrecht
pubSpringer Science & Business Media
doi10.1007/s11051-016-3623-7
urlhttp://search.proquest.com/docview/1837165283/
eissn1572896X
date2016-11-01