References
Wagner, F.E., Haslbeck, S., Stievano, L., Calogero, S., Pankhurst, Q.A., Martinek, K.-P.: Before striking gold in gold-ruby glass. Nature 407, 691–692 (2000)
Martin, R.M.: Electronic structure – basic theory and practical Methods. Cambridge University Press, Cambridge (2004)
Sholl, D., Steckel, J.A.: Density Functional Theory: A Practical Introduction. Wiley-Interscience, Hoboken (2009)
Mariscal, M.M., Oviedo, O.A., Leiva, E.P.M.: Metal Clusters and Nanoalloys – From Modeling to Applications. Springer, New York (2013)
Desireddy, A., et al.: Ultrastable silver nanoparticles. Nature 501, 399–402 (2013)
Barnard, A.S.: Direct comparison of kinetic and thermodynamic influences on gold nanomorphology. Acc. Chem. Res. 45, 1688–1697 (2012)
Gruner, M.E., Rollmann, G., Hucht, A., Entel, P.: Structural and magnetic properties of transition metal nanoparticles from first principles. In: Haug, R. (ed.) Advances in Solid State Physics, pp. 117–128. Springer, Berlin (2008)
Chepulskii, R.V., Curtarolo, S.: Ab initio insights on the shapes of platinum nanocatalysts. ACS Nano 5, 247–254 (2011)
Karlberg, G.S., Jaramillo, T.F., Skúlason, E., Rossmeisl, J., Bligaard, T., Nørskov, J.K.: Cyclic voltammograms for H on Pt (111) and Pt(100) from first principles. Phys. Rev. Lett. 99, 126101 (2007)
Bealing, C.R., Baumgardner, W.J., Choi, J.J., Hanrath, T., Hennig, R.G.: Predicting nanocrystal shape through consideration of surface-ligand interactions. ACS Nano 6, 2118–2127 (2012)
Mpourmpakis, G., Vlachos, D.G.: Growth mechanisms of metal nanoparticles via first principles. Phys. Rev. Lett. 102, 155505 (2009)
Salvalaglio, M., Vetter, T., Giberti, F., Mazzotti, M., Parrinello, M.: Uncovering molecular details of urea crystal growth in the presence of additives. J. Am. Chem. Soc. 134, 17221–17233 (2012)
Zhou, Y., Saidi, W.A., Fichthorn, K.A.: A force field for describing the polyvinylpyrrolidone-mediated solution-phase synthesis of shape-selective Ag nanoparticles. J. Phys. Chem. C 118, 3366–3374 (2014)
Artrith, N., Kolpak, A.M.: Understanding the composition and activity of electrocatalytic nanoalloys in aqueous solvents: a combination of DFT and accurate neural network potentials. Nano Lett. 14, 2670–2676 (2014)
Persson, K.A., Waldwick, B., Lazic, P., Ceder, G.: Prediction of solid-aqueous equilibria: scheme to combine first-principles calculations of solids with experimental aqueous states. Phys. Rev. B 85, 235438 (2012)
Jennings, P.C., Aleksandrov, H.A., Neyman, K.M., Johnston, R.L.: A DFT study of oxygen dissociation on platinum based nanoparticles. Nanoscale 6, 1153–1165 (2014)
Barcaro, G., Fortunelli, A.: A Magic Pd-Ag Binary Cluster on the Fs-Defected MgO(100) Surface. J. Phys. Chem. C 111, 11384–11389 (2007)
Barnard, A.S., Young, N.P., Kirkland, A.I., van Huis, M.A., Xu, H.: Nanogold: A Quantitative Phase Map. ACS Nano 3, 1431–1436 (2009)
Han, B.C., Miranda, C.R., Ceder, G.: Effect of Particle Size and Surface Structure on Adsorption of O and OH on Platinum Nanoparticles: A First-Principles Study. Phys. Rev. B 77, 075410 (2008). doi:10.1103/PhysRevB.77.075410
Author information
Authors and Affiliations
Corresponding author
Editor information
Editors and Affiliations
Additional information
Notes
Readers may view, browse, and/or download material for temporary copying purposes only, provided these uses are for noncommercial personal purposes. Except as provided by law, this material may not be further reproduced, distributed, transmitted, modified, adapted, performed, displayed, published, or sold in whole or part, without prior written permission from the American Physical Society.
Rights and permissions
Copyright information
© 2015 Springer Science+Business Media Dordrecht
About this entry
Cite this entry
Bonnet, N. (2015). Metal Nanoparticles from First Principles. In: Bhushan, B. (eds) Encyclopedia of Nanotechnology. Springer, Dordrecht. https://doi.org/10.1007/978-94-007-6178-0_100939-1
Download citation
DOI: https://doi.org/10.1007/978-94-007-6178-0_100939-1
Received:
Accepted:
Published:
Publisher Name: Springer, Dordrecht
Online ISBN: 978-94-007-6178-0
eBook Packages: Springer Reference Chemistry and Mat. ScienceReference Module Physical and Materials ScienceReference Module Chemistry, Materials and Physics