Oxidation of InP nanowires: a first principles molecular dynamics study.

Autor: Berwanger M; Departmento de Física, Universidade Federal de Santa Maria, 97105-900, Santa Maria, RS, Brazil. aline-ls@mail.ufsm.br., Schoenhalz AL; Departmento de Física, Universidade Federal de Santa Maria, 97105-900, Santa Maria, RS, Brazil. aline-ls@mail.ufsm.br., Dos Santos CL; Área de Ciências Tecnológicas, Centro Universitário Franciscano, 97010-032, Santa Maria, RS, Brazil., Piquini P; Departmento de Física, Universidade Federal de Santa Maria, 97105-900, Santa Maria, RS, Brazil. aline-ls@mail.ufsm.br.

Publikováno v: Physical chemistry chemical physics : PCCP [Phys Chem Chem Phys] 2016 Nov 16; Vol. 18 (45), pp. 31101-31106.

Cobalt-doped ZnO nanocrystals: quantum confinement and surface effects from ab initio methods.

Autor: Schoenhalz AL; Universidade Federal do ABC, Santo André, SP, Brazil. gustavo.dalpian@ufabc.edu.br., Dalpian GM

Publikováno v: Physical chemistry chemical physics : PCCP [Phys Chem Chem Phys] 2013 Oct 14; Vol. 15 (38), pp. 15863-8. Date of Electronic Publication: 2013 Aug 13.

Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.

Autor: Hummelshøj JS; The 2008 CAMD Summer School in Electronic Structure Theory and Materials Design, Center for Atomic-scale Materials Design, Department of Physics, Technical University of Denmark, DK-2800 Kgs. Lyngby, Denmark., Landis DD, Voss J, Jiang T, Tekin A, Bork N, Dułak M, Mortensen JJ, Adamska L, Andersin J, Baran JD, Barmparis GD, Bell F, Bezanilla AL, Bjork J, Björketun ME, Bleken F, Buchter F, Bürkle M, Burton PD, Buus BB, Calborean A, Calle-Vallejo F, Casolo S, Chandler BD, Chi DH, Czekaj I, Datta S, Datye A, DeLaRiva A, Despoja V, Dobrin S, Engelund M, Ferrighi L, Frondelius P, Fu Q, Fuentes A, Fürst J, García-Fuente A, Gavnholt J, Goeke R, Gudmundsdottir S, Hammond KD, Hansen HA, Hibbitts D, Hobi E Jr, Howalt JG, Hruby SL, Huth A, Isaeva L, Jelic J, Jensen IJ, Kacprzak KA, Kelkkanen A, Kelsey D, Kesanakurthi DS, Kleis J, Klüpfel PJ, Konstantinov I, Korytar R, Koskinen P, Krishna C, Kunkes E, Larsen AH, Lastra JM, Lin H, Lopez-Acevedo O, Mantega M, Martínez JI, Mesa IN, Mowbray DJ, Mýrdal JS, Natanzon Y, Nistor A, Olsen T, Park H, Pedroza LS, Petzold V, Plaisance C, Rasmussen JA, Ren H, Rizzi M, Ronco AS, Rostgaard C, Saadi S, Salguero LA, Santos EJ, Schoenhalz AL, Shen J, Smedemand M, Stausholm-Møller OJ, Stibius M, Strange M, Su HB, Temel B, Toftelund A, Tripkovic V, Vanin M, Viswanathan V, Vojvodic A, Wang S, Wellendorff J, Thygesen KS, Rossmeisl J, Bligaard T, Jacobsen KW, Nørskov JK, Vegge T

Publikováno v: The Journal of chemical physics [J Chem Phys] 2009 Jul 07; Vol. 131 (1), pp. 014101.

InP colloidal quantum dots for visible and near-infrared photonics.

Autor: Almeida, Guilherme, Ubbink, Reinout F., Stam, Maarten, du Fossé, Indy, Houtepen, Arjan J.

Publikováno v: Nature Reviews Materials; Nov2023, Vol. 8 Issue 11, p742-758, 17p

Development and characterization of varying percentages of Ru-doped ZnO (xRu:ZnO; 1% ≤ x ≤ 5%) as a potential material for LPG sensing at room temperature.

Autor: Singh, Prabhat Kumar¹ (AUTHOR), Singh, Neetu¹ (AUTHOR), Singh, Mridula¹ (AUTHOR), Singh, Saurabh Kumar² (AUTHOR), Tandon, Poonam¹ (AUTHOR) poonam_tandon@yahoo.co.uk

Publikováno v: Applied Physics A: Materials Science & Processing. May2020, Vol. 126 Issue 5, p1-14. 14p. 4 Diagrams, 5 Charts, 12 Graphs.