|
View: |
Part 1: Document Description
|
|
Citation |
|
|---|---|
|
Title: |
Replication Data for: Quantitative Prediction of Position and Orientation for Platonic Nanoparticles at Liquid/Liquid Interfaces |
|
Identification Number: |
doi:10.21979/N9/4OC5RI |
|
Distributor: |
DR-NTU (Data) |
|
Date of Distribution: |
2019-06-28 |
|
Version: |
1 |
|
Bibliographic Citation: |
Shi Wenxiong, 2019, "Replication Data for: Quantitative Prediction of Position and Orientation for Platonic Nanoparticles at Liquid/Liquid Interfaces", https://doi.org/10.21979/N9/4OC5RI, DR-NTU (Data), V1 |
|
Citation |
|
|
Title: |
Replication Data for: Quantitative Prediction of Position and Orientation for Platonic Nanoparticles at Liquid/Liquid Interfaces |
|
Identification Number: |
doi:10.21979/N9/4OC5RI |
|
Authoring Entity: |
Shi Wenxiong (Nanyang Technological University) |
|
Software used in Production: |
gromac |
|
Grant Number: |
RG107/15 |
|
Distributor: |
DR-NTU (Data) |
|
Access Authority: |
Hao, Wei |
|
Depositor: |
Hao, Wei |
|
Date of Deposit: |
2019-05-28 |
|
Holdings Information: |
https://doi.org/10.21979/N9/4OC5RI |
|
Study Scope |
|
|
Keywords: |
Engineering, Physics, Engineering, Physics, superlattice, nano particle |
|
Abstract: |
Because of their intrinsic geometric structure of vertices, edges, and facets, Platonic nanoparticles are promising materials in plasmonics and biosensing. Their position and orientation often play a crucial role in determining the resultant assembly structures at a liquid/liquid interface. Here, we numerically explored all possible orientations of three Platonic nanoparticles (tetrahedron, cube, and octahedron) and found that a specific orientation (vertex-up, edge-up, or facet-up) is more preferred than random orientations. We also demonstrated their positions and orientations can be quantitatively predicted when the surface tensions dominate their total interaction energies. The line tensions may affect their positions and orientations only when total interaction energies are close to each other for more than one orientation. The molecular dynamics simulation results were in excellent agreement with our theoretical predictions. Our theory will advance our ability toward predicting the final structures of Platonic nanoparticle assemblies at a liquid/liquid interface. |
|
Kind of Data: |
process-produced data |
|
Methodology and Processing |
|
|
Sources Statement |
|
|
Data Access |
|
|
Other Study Description Materials |
|
|
Related Publications |
|
|
Citation |
|
|
Identification Number: |
10.1021/acs.jpclett.7b03187 |
|
Bibliographic Citation: |
Shi, W., Zhang, Z., & Li, S. (2018). Quantitative Prediction of Position and Orientation for Platonic Nanoparticles at Liquid/Liquid Interfaces. The journal of physical chemistry letters, 9(2), 373-382. |
|
Citation |
|
|
Identification Number: |
10356/88888 |
|
Bibliographic Citation: |
Shi, W., Zhang, Z., & Li, S. (2018). Quantitative Prediction of Position and Orientation for Platonic Nanoparticles at Liquid/Liquid Interfaces. The journal of physical chemistry letters, 9(2), 373-382. |
|
Label: |
Figure3a1inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a1.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a2inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a2.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a3inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a3.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a4inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a4.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a5inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a5.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a6inset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3a6.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b1.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b2.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b3.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b4.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b5.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure3b6.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure4a.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure4b.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure4c.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5a1.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5a2.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5a3.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5a4.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5b1.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5b2.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5b3.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5b4.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5c1.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5c2.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5c3.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5d1.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5d2.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure5d3.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure6.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7a.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7binset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7b.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7cinset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7c.opj |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7dinset.gro |
|
Notes: |
application/octet-stream |
|
Label: |
Figure7d.opj |
|
Notes: |
application/octet-stream |