Publicações

Curriculum Lattes

http://scholar.google.com/citations?hl=en&user=95SvbM8AAAAJ

Mostrar todos

39 entradas « 1 de 2 »
1.

JM; Sousa, Bizao

Elastic Properties of Graphyne-based Nanotubes Online

2019, (ArXiv preprint.).

Resumo | Links | BibTeX

2.

JM; Sousa, Bizao

Elastic Properties of Graphyne-Based Nanotubes Journal Article

Em: Computational Materials Science, vol. 170, pp. 109153, 2019.

Resumo | Links | BibTeX

3.

Chipara, A. C.; Tsafack, T.; Owuor, P. S.; Yeon, J.; Junkermeier, C. E.; van Duin, A. C. T.; Bhowmick, S.; Asif, S. A. S.; Radhakrishnan, S.; Park, J. H.; Brunetto, G.; Kaipparettu, B. A.; Galvão, D. S.; Chipara, M.; Lou, J.; Tsang, H. H.; Dubey, M.; Vajtai, R.; Tiwary, C. S.; Ajayan, P. M.

Underwater Adhesive using Solid–liquid Polymer Mixes Journal Article

Em: Materials Today Chemistry, vol. 9, pp. 149-157, 2018.

Resumo | Links | BibTeX

4.

Oliveira, Eliezer F.; Autreto, Pedro A. S.; Woellner, Cristiano F.; Galvao, Douglas S.

On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation Journal Article

Em: Carbon, vol. 139, pp. 782-788, 2018.

Resumo | Links | BibTeX

5.

Balan, Aravind Puthirath; Radhakrishnan, Sruthi; Woellner, Cristiano F.; Sinha, Shyam K.; Deng, Liangzi; de los Reyes, Carlos; Rao, Manmadha; Paulose, Maggie; Neupane, Ram; Vajtai, Robert; Chu, Ching-Wu; Costin, Gelu; Galvao, Douglas S.; Marti, Angel A.; van Aken, Peter; Varghese, Oomman K; Tiwary, Chandra Sekhar; Anantharaman, M R; Ajayan, Pulickel M

Exfoliation of a non-van der Waals material from iron ore hematite Journal Article

Em: Nature Nanotechnology, vol. 13, pp. 602–610, 2018.

Resumo | Links | BibTeX

6.

Eliezer F.; Autreto Oliveira, Pedro A. S. ; Woellner

On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation Online

2018, (preprint ArXiv:1804.07215).

Resumo | Links | BibTeX

7.

Kabbani, Mohamad A.; Kochat, Vidya; Bhowmick, Sanjit; Soto, Matias; Som, Anirban; Krishnadas, K. R.; Woellner, Cristiano F.; Jaques, Ygor M.; Barrera, Enrique V.; Asif, Syed; Vajtai, Robert; Pradeep, Thalappil; Galvão, Douglas S.; Kabbani, Ahmad T.; Tiwary, Chandra Sekhar; Ajayan, Pulickel M.

Consolidation of Functionalized Graphene at Ambient Temperature via Mechano-chemistry Journal Article

Em: Carbon, vol. 134, não 8, pp. 491-499, 2018.

Resumo | Links | BibTeX

8.

Han, Yang; Zhou, Yanguang; Qin, Guangzhao; Dong, Jinming; Galvao, Douglas S; Hu, Ming

Unprecedented mechanical response of the lattice thermal conductivity of auxetic carbon crystals Journal Article

Em: Carbon, vol. 122, pp. 374-380, 2017.

Resumo | Links | BibTeX

9.

de Sousa, JM; Aguiar, AL; Girao, EC; Fonseca, Alexandre F; AG Filho, Souza; Galvao, Douglas S

Mechanical Properties and Fracture Patterns of Pentagraphene Membranes Online

2017, (preprint arXiv:1703.03789).

Resumo | Links | BibTeX

10.

Borges, Daiane Damasceno; Maurin, Guillaume; Galvao, Douglas S

Design of Porous Metal-Organic Frameworks for Adsorption Driven Thermal Batteries Journal Article

Em: MRS Advances, vol. 2017, pp. 1-6, 2017.

Resumo | Links | BibTeX

11.

Chandra Sekhar Tiwary Sujin P Jose, Suppanat Kosolwattana

Enhanced supercapacitor performance of a 3D architecture tailored using atomically thin rGO–MoS 2 2D sheets Journal Article

Em: RSC Advances, vol. 6, pp. 93384-93393, 2016.

Resumo | Links | BibTeX

12.

Chandra Sekhar Tiwary Mohamad A Kabbani, Anirban Som

A generic approach for mechano-chemical reactions between carbon nanotubes of different functionalities Journal Article

Em: Carbon, vol. 104, pp. 196-202, 2016.

Resumo | Links | BibTeX

13.

Yongji Gong Bo Li, Zhili Hu

Solid–Vapor Reaction Growth of Transition‐Metal Dichalcogenide Monolayers Journal Article

Em: Angewandte Chemie, vol. 128, não 36, pp. 10814-10819, 2016.

Resumo | Links | BibTeX

14.

Rodrigo Prioli Clara M Almeida, Benjamin Fragneaud

Giant and Tunable Anisotropy of Nanoscale Friction in Graphene Journal Article

Em: Nature Scientific Reports, vol. 6, pp. 31569, 2016.

Resumo | Links | BibTeX

15.

Gao, Guanhui; Mathkar, Akshay; Martins, Eric Perim; Galvao, Douglas S; Gao, Duyang; da Silva Autreto, Pedro Alves; Sun, Chengjun; Cai, Lintao; Ajayan, Pulickel M

Designing nanoscaled hybrids from atomic layered boron nitride with silver nanoparticle deposition Journal Article

Em: Journal of Materials Chemistry A, vol. 2, não 9, pp. 3148–3154, 2014.

Resumo | Links | BibTeX

16.

Perim, E; Paupitz, R; Botari, T; Galvao, DS

One-dimensional silicon and germanium nanostructures with no carbon analogues Journal Article

Em: Physical Chemistry Chemical Physics, vol. 16, não 44, pp. 24570–24574, 2014.

Resumo | Links | BibTeX

17.

Perim, Eric; Paupitz, Ricardo; Botari, Tiago; Galvao, Douglas S

Novel Semiconducting Silicon and Germanium Nanotubes Journal Article

Em: arXiv preprint arXiv:1403.2061, 2014.

Resumo | Links | BibTeX

18.

Autreto, Pedro Alves da Silva; Galvao, Douglas S; Artacho, Emilio

Species Fractionation in Atomic Chains from Mechanically Stretched Alloys Journal Article

Em: arXiv preprint arXiv:1312.1285, 2013.

Resumo | Links | BibTeX

19.

Brunetto, Gustavo; Autreto, PAS; Machado, Leonardo Dantas; Santos, BI; dos Santos, Ricardo PB; Galvao, Douglas S

Nonzero gap two-dimensional carbon allotrope from porous graphene Journal Article

Em: The Journal of Physical Chemistry C, vol. 116, não 23, pp. 12810–12813, 2012.

Resumo | Links | BibTeX

20.

PAS Autreto MJ Lagos, SB Legoas

Temperature effects on the occurrence of long interatomic distances in atomic chains formed from stretched gold nanowires Journal Article

Em: Nanotechnology, vol. 22, não 9, pp. 095705, 2011.

Resumo | Links | BibTeX

39 entradas « 1 de 2 »

Mostrar todos

2019

39.
Elastic Properties of Graphyne-based Nanotubes

JM; Sousa, Bizao

Elastic Properties of Graphyne-based Nanotubes Online

2019, (ArXiv preprint.).

Resumo | Links | BibTeX | Tags: DFT, Graphynes, Molecular Dynamics, Nanotubes

38.
Elastic Properties of Graphyne-Based Nanotubes

JM; Sousa, Bizao

Elastic Properties of Graphyne-Based Nanotubes Journal Article

Em: Computational Materials Science, vol. 170, pp. 109153, 2019.

Resumo | Links | BibTeX | Tags: DFT, Graphynes, Molecular Dynamics, Nanotubes

2018

37.
Underwater Adhesive using Solid–liquid Polymer Mixes

Chipara, A. C.; Tsafack, T.; Owuor, P. S.; Yeon, J.; Junkermeier, C. E.; van Duin, A. C. T.; Bhowmick, S.; Asif, S. A. S.; Radhakrishnan, S.; Park, J. H.; Brunetto, G.; Kaipparettu, B. A.; Galvão, D. S.; Chipara, M.; Lou, J.; Tsang, H. H.; Dubey, M.; Vajtai, R.; Tiwary, C. S.; Ajayan, P. M.

Underwater Adhesive using Solid–liquid Polymer Mixes Journal Article

Em: Materials Today Chemistry, vol. 9, pp. 149-157, 2018.

Resumo | Links | BibTeX | Tags: Adhesives, DFT, Molecular Dynamics, Polymer

36.
On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation

Oliveira, Eliezer F.; Autreto, Pedro A. S.; Woellner, Cristiano F.; Galvao, Douglas S.

On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation Journal Article

Em: Carbon, vol. 139, pp. 782-788, 2018.

Resumo | Links | BibTeX | Tags: carbon allotropes, DFT, Molecular Dynamics, novamenes

35.
Exfoliation of a non-van der Waals material from iron ore hematite

Balan, Aravind Puthirath; Radhakrishnan, Sruthi; Woellner, Cristiano F.; Sinha, Shyam K.; Deng, Liangzi; de los Reyes, Carlos; Rao, Manmadha; Paulose, Maggie; Neupane, Ram; Vajtai, Robert; Chu, Ching-Wu; Costin, Gelu; Galvao, Douglas S.; Marti, Angel A.; van Aken, Peter; Varghese, Oomman K; Tiwary, Chandra Sekhar; Anantharaman, M R; Ajayan, Pulickel M

Exfoliation of a non-van der Waals material from iron ore hematite Journal Article

Em: Nature Nanotechnology, vol. 13, pp. 602–610, 2018.

Resumo | Links | BibTeX | Tags: DFT, Hematene, Molecular Dynamics, van der Waals solids

34.
On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation

Eliezer F.; Autreto Oliveira, Pedro A. S. ; Woellner

On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation Online

2018, (preprint ArXiv:1804.07215).

Resumo | Links | BibTeX | Tags: carbon allotropes, DFT, Molecular Dynamics, novamenes

33.
Consolidation of Functionalized Graphene at Ambient Temperature via Mechano-chemistry

Kabbani, Mohamad A.; Kochat, Vidya; Bhowmick, Sanjit; Soto, Matias; Som, Anirban; Krishnadas, K. R.; Woellner, Cristiano F.; Jaques, Ygor M.; Barrera, Enrique V.; Asif, Syed; Vajtai, Robert; Pradeep, Thalappil; Galvão, Douglas S.; Kabbani, Ahmad T.; Tiwary, Chandra Sekhar; Ajayan, Pulickel M.

Consolidation of Functionalized Graphene at Ambient Temperature via Mechano-chemistry Journal Article

Em: Carbon, vol. 134, não 8, pp. 491-499, 2018.

Resumo | Links | BibTeX | Tags: DFT, Graphene, Mechanochemistry, Molecular Dynamics

2017

32.
Unprecedented mechanical response of the lattice thermal conductivity of auxetic carbon crystals

Han, Yang; Zhou, Yanguang; Qin, Guangzhao; Dong, Jinming; Galvao, Douglas S; Hu, Ming

Unprecedented mechanical response of the lattice thermal conductivity of auxetic carbon crystals Journal Article

Em: Carbon, vol. 122, pp. 374-380, 2017.

Resumo | Links | BibTeX | Tags: Auxetics, DFT, Thermal, Tubulanes

31.
Mechanical Properties and Fracture Patterns of Pentagraphene Membranes

de Sousa, JM; Aguiar, AL; Girao, EC; Fonseca, Alexandre F; AG Filho, Souza; Galvao, Douglas S

Mechanical Properties and Fracture Patterns of Pentagraphene Membranes Online

2017, (preprint arXiv:1703.03789).

Resumo | Links | BibTeX | Tags: DFT, Mechanical Properties, Molecular Dynamics, pentagraphene

30.
Design of Porous Metal-Organic Frameworks for Adsorption Driven Thermal Batteries

Borges, Daiane Damasceno; Maurin, Guillaume; Galvao, Douglas S

Design of Porous Metal-Organic Frameworks for Adsorption Driven Thermal Batteries Journal Article

Em: MRS Advances, vol. 2017, pp. 1-6, 2017.

Resumo | Links | BibTeX | Tags: DFT, MOFs, thermal batteries

2016

29.
Enhanced supercapacitor performance of a 3D architecture tailored using atomically thin rGO–MoS 2 2D sheets

Chandra Sekhar Tiwary Sujin P Jose, Suppanat Kosolwattana

Enhanced supercapacitor performance of a 3D architecture tailored using atomically thin rGO–MoS 2 2D sheets Journal Article

Em: RSC Advances, vol. 6, pp. 93384-93393, 2016.

Resumo | Links | BibTeX | Tags: Chalcogenides, DFT, graphene oxide, Molecular Dynamics

28.
A generic approach for mechano-chemical reactions between carbon nanotubes of different functionalities

Chandra Sekhar Tiwary Mohamad A Kabbani, Anirban Som

A generic approach for mechano-chemical reactions between carbon nanotubes of different functionalities Journal Article

Em: Carbon, vol. 104, pp. 196-202, 2016.

Resumo | Links | BibTeX | Tags: Carbon Nanotubes, DFT, Fracture, Mechano-chemistry, Molecular Dynamics

27.
Solid–Vapor Reaction Growth of Transition‐Metal Dichalcogenide Monolayers

Yongji Gong Bo Li, Zhili Hu

Solid–Vapor Reaction Growth of Transition‐Metal Dichalcogenide Monolayers Journal Article

Em: Angewandte Chemie, vol. 128, não 36, pp. 10814-10819, 2016.

Resumo | Links | BibTeX | Tags: Chalcogenides, cvd, DFT

26.
Giant and Tunable Anisotropy of Nanoscale Friction in Graphene

Rodrigo Prioli Clara M Almeida, Benjamin Fragneaud

Giant and Tunable Anisotropy of Nanoscale Friction in Graphene Journal Article

Em: Nature Scientific Reports, vol. 6, pp. 31569, 2016.

Resumo | Links | BibTeX | Tags: DFT, Graphene, Molecular Dynamics, Tribology

2014

25.
Designing nanoscaled hybrids from atomic layered boron nitride with silver nanoparticle deposition

Gao, Guanhui; Mathkar, Akshay; Martins, Eric Perim; Galvao, Douglas S; Gao, Duyang; da Silva Autreto, Pedro Alves; Sun, Chengjun; Cai, Lintao; Ajayan, Pulickel M

Designing nanoscaled hybrids from atomic layered boron nitride with silver nanoparticle deposition Journal Article

Em: Journal of Materials Chemistry A, vol. 2, não 9, pp. 3148–3154, 2014.

Resumo | Links | BibTeX | Tags: DFT, nano particles

24.
One-dimensional silicon and germanium nanostructures with no carbon analogues

Perim, E; Paupitz, R; Botari, T; Galvao, DS

One-dimensional silicon and germanium nanostructures with no carbon analogues Journal Article

Em: Physical Chemistry Chemical Physics, vol. 16, não 44, pp. 24570–24574, 2014.

Resumo | Links | BibTeX | Tags: DFT, Germanium, Nanotubes, Silicon

23.
Novel Semiconducting Silicon and Germanium Nanotubes

Perim, Eric; Paupitz, Ricardo; Botari, Tiago; Galvao, Douglas S

Novel Semiconducting Silicon and Germanium Nanotubes Journal Article

Em: arXiv preprint arXiv:1403.2061, 2014.

Resumo | Links | BibTeX | Tags: DFT, Germanium, Nanotubes, Silicon

2013

22.
Species Fractionation in Atomic Chains from Mechanically Stretched Alloys

Autreto, Pedro Alves da Silva; Galvao, Douglas S; Artacho, Emilio

Species Fractionation in Atomic Chains from Mechanically Stretched Alloys Journal Article

Em: arXiv preprint arXiv:1312.1285, 2013.

Resumo | Links | BibTeX | Tags: Atomic Chains, DFT, Mech, Mechanical Properties, Metallic Nanowires

2012

21.
Nonzero gap two-dimensional carbon allotrope from porous graphene

Brunetto, Gustavo; Autreto, PAS; Machado, Leonardo Dantas; Santos, BI; dos Santos, Ricardo PB; Galvao, Douglas S

Nonzero gap two-dimensional carbon allotrope from porous graphene Journal Article

Em: The Journal of Physical Chemistry C, vol. 116, não 23, pp. 12810–12813, 2012.

Resumo | Links | BibTeX | Tags: BPC, DFT, Graphene, Porous Graphene

2011

20.
Temperature effects on the occurrence of long interatomic distances in atomic chains formed from stretched gold nanowires

PAS Autreto MJ Lagos, SB Legoas

Temperature effects on the occurrence of long interatomic distances in atomic chains formed from stretched gold nanowires Journal Article

Em: Nanotechnology, vol. 22, não 9, pp. 095705, 2011.

Resumo | Links | BibTeX | Tags: DFT, Gold, Metallic Nanowires, TEM

19.
Intrinsic Stability of the Smallest Possible Silver Nanotube

Autreto, PAS; Lagos, MJ; Sato, F; Bettini, J; Rocha, AR; Rodrigues, V; Ugarte, D; Galvao, DS

Intrinsic Stability of the Smallest Possible Silver Nanotube Journal Article

Em: Physical Review Letters, vol. 106, não 6, pp. 065501, 2011.

Resumo | Links | BibTeX | Tags: DFT, Mechanical Properties, Metallic Nanowires, New Structures, top20

18.
Mechanical deformation of nanoscale metal rods: when size and shape matter

Lagos, Maureen J; Sato, Fernando; Galvao, Douglas S; Ugarte, Daniel

Mechanical deformation of nanoscale metal rods: when size and shape matter Journal Article

Em: Physical Review Letters, vol. 106, não 5, pp. 055501, 2011.

Resumo | Links | BibTeX | Tags: Defects, DFT, Mechanical Properties, Metallic Nanowires

17.
Tuning Electronic and Structural Properties of Triple Layers of Intercalated Graphene and Hexagonal Boron Nitride: An Ab-initio Study.

Coutinho, Samir S; Azevedo, David L; Galvao, Douglas S

Tuning Electronic and Structural Properties of Triple Layers of Intercalated Graphene and Hexagonal Boron Nitride: An Ab-initio Study. Journal Article

Em: MRS Proceedings, vol. 1307, pp. mrsf10–1307, 2011.

Resumo | Links | BibTeX | Tags: BN, DFT, Graphene, Heterostructures

2010

16.
Adsorption configuration effects on the surface diffusion of large organic molecules: The case of Violet Lander

Sato, F; Legoas, SB; Otero, R; Hummelink, F; Thostrup, P; Lægsgaard, E; Stensgaard, I; Besenbacher, F; Galvao, DS

Adsorption configuration effects on the surface diffusion of large organic molecules: The case of Violet Lander Journal Article

Em: The Journal of chemical physics, vol. 133, não 22, pp. 224702, 2010.

Resumo | Links | BibTeX | Tags: DFT, Diffusion, Molecular Electronics, STM, Violet Lander

15.
Carbon nanotube with square cross-section: An ab initio investigation

Autreto, PAS; Legoas, SB; Flores, MZS; Galvao, DS

Carbon nanotube with square cross-section: An ab initio investigation Journal Article

Em: The Journal of chemical physics, vol. 133, não 12, pp. 124513, 2010.

Resumo | Links | BibTeX | Tags: Carbon Nanotubes, DFT, New Structures, square tubes

14.
Temperature effects on the atomic arrangement and conductance of atomic-size gold nanowires generated by mechanical stretching

Lagos, MJ; Sato, F; Autreto, PAS; Galvao, DS; Rodrigues, V; Ugarte, D

Temperature effects on the atomic arrangement and conductance of atomic-size gold nanowires generated by mechanical stretching Journal Article

Em: Nanotechnology, vol. 21, não 48, pp. 485702, 2010.

Resumo | Links | BibTeX | Tags: DFT, Mechanical Properties, Metallic Nanowires, Quantum Transport, TEM

2008

13.
Mobius and twisted graphene nanoribbons: Stability, geometry, and electronic properties

E. W. S.; Freire Caetano, V. N. ; dos Santos

Mobius and twisted graphene nanoribbons: Stability, geometry, and electronic properties Journal Article

Em: THE JOURNAL OF CHEMICAL PHYSICS, vol. 128, pp. 164719, 2008.

Resumo | Links | BibTeX | Tags: DFT, Graphene, Mobis, NanoRibbons, Structure

12.
Large electromechanical response in silicon nanowires predicted from first-principles electronic structure calculations

Rurali, R; Cartoixa, X; Galvao, DS

Large electromechanical response in silicon nanowires predicted from first-principles electronic structure calculations Journal Article

Em: Physical Review B, vol. 77, não 7, pp. 073403, 2008.

Resumo | Links | BibTeX | Tags: DFT, Eletroactuation, Nanowires, Silicon

11.
Some electronic properties of saturated and unsaturated cubane oligomers using DFT-based calculations

Konstantinova, Elena; Camilo Jr, Alexandre; Barone, Paulo MVB; Dantas, Socrates O; Galvao, Douglas S

Some electronic properties of saturated and unsaturated cubane oligomers using DFT-based calculations Journal Article

Em: Journal of Molecular Structure: THEOCHEM, vol. 868, não 1, pp. 37–41, 2008.

Resumo | Links | BibTeX | Tags: Cubanes, DFT, Polymer

2007

10.
Is Small Perfect? Size Limit to Defect Formation in Pyramidal Pt Nanocontacts

Rodrigues, Varlei; Sato, Fernando; Galvao, Douglas S; Ugarte, Daniel

Is Small Perfect? Size Limit to Defect Formation in Pyramidal Pt Nanocontacts Journal Article

Em: arXiv preprint arXiv:0707.4187, 2007.

Resumo | Links | BibTeX | Tags: Defects, DFT, Metallic Nanowires, Structure, TEM

9.
Size limit of defect formation in pyramidal Pt nanocontacts

Rodrigues, V; Sato, F; Galvao, DS; Ugarte, D

Size limit of defect formation in pyramidal Pt nanocontacts Journal Article

Em: Physical Review Letters, vol. 99, não 25, pp. 255501, 2007.

Resumo | Links | BibTeX | Tags: DFT, Metallic Nanowires, Platinum, Structure, TEM, top20

2006

8.
Doping of zigzag carbon nanotubes through the encapsulation of small fullerenes

Troche, KS; Coluci, VR; Rurali, R; Galvao, DS

Doping of zigzag carbon nanotubes through the encapsulation of small fullerenes Journal Article

Em: arXiv preprint cond-mat/0607197, 2006.

Resumo | Links | BibTeX | Tags: CNT encapsulation, DFT, Molecular Dynamics

7.
Geometric and electronic structure of carbon nanotube networks:'super'-carbon nanotubes

Coluci, Vitor R; Galvao, Douglas S; Jorio, A

Geometric and electronic structure of carbon nanotube networks:'super'-carbon nanotubes Journal Article

Em: Nanotechnology, vol. 17, não 3, pp. 617, 2006.

Resumo | Links | BibTeX | Tags: DFT, Mechanical Properties, Molecular Dynamics, Super Carbons

6.
Prediction of Giant Electro-actuation for Carbon Nanoscrolls

Rurali, R; Coluci, VR; Galvao, DS

Prediction of Giant Electro-actuation for Carbon Nanoscrolls Journal Article

Em: arXiv preprint cond-mat/0603239, 2006.

Resumo | Links | BibTeX | Tags: DFT, Electroactuation, Electronic Structure, Scrolls

5.
Prediction of giant electroactuation for papyruslike carbon nanoscroll structures: first-principles calculations

Rurali, R; Coluci, VR; Galvao, DS

Prediction of giant electroactuation for papyruslike carbon nanoscroll structures: first-principles calculations Journal Article

Em: Physical Review B, vol. 74, não 8, pp. 085414, 2006.

Resumo | Links | BibTeX | Tags: DFT, Electronic Structure, Eletroactuation, Scrolls

2005

4.
Structural and electronic properties of radialenes and related systems

Konstantinova, Elena; Galvao, Douglas S; Barone, Paulo MVB; Dantas, Socrates O

Structural and electronic properties of radialenes and related systems Journal Article

Em: Journal of Molecular Structure: THEOCHEM, vol. 729, não 3, pp. 203–210, 2005.

Resumo | Links | BibTeX | Tags: DFT, Electronic Structure, Radialenes

2004

3.
Contaminants in suspended gold chains: An ab initio molecular dynamics study

Legoas, Sergio B; Rodrigues, Varlei; Ugarte, Daniel; Galvao, Douglas S

Contaminants in suspended gold chains: An ab initio molecular dynamics study Journal Article

Em: Physical Review Letters, vol. 93, não 21, pp. 216103, 2004.

Resumo | Links | BibTeX | Tags: DFT, Electronic Structure, Linear Atomic Chains, Metallic Nanowires, top20

2002

2.
Origin of anomalously long interatomic distances in suspended gold chains

Legoas, Sergio B; Galvao, Douglas S; Rodrigues, Varlei; Ugarte, Daniel

Origin of anomalously long interatomic distances in suspended gold chains Journal Article

Em: Physical Review Letters, vol. 88, não 7, pp. 076105, 2002.

Resumo | Links | BibTeX | Tags: DFT, Electronic Structure, Linear Atomic Chains, Metallic Nanowires, TEM, top20

1.
The Role of Carbon Contamination in Suspended Gold Nanowires

Legoas, Sergio B; Galvao, Douglas S; Rodrigues, Varlei; Ugarte, Daniel

The Role of Carbon Contamination in Suspended Gold Nanowires Journal Article

Em: MRS Proceedings, vol. 738, pp. G14–6, 2002.

Resumo | Links | BibTeX | Tags: DFT, Electronic Structure, Linear Atomic Chains, Metallic Nanowires, TEM

 

 

Apresentações em conferências

Curriculum Lattes http://scholar.google.com/citations?hl=en&user=95SvbM8AAAAJ  

Congressos

Curriculum Lattes http://scholar.google.com/citations?hl=en&user=95SvbM8AAAAJ  

Deixe um comentário

Seu e-mail não será publicado.