Journal ArticleDOI
Special points for brillouin-zone integrations
Hendrik J. Monkhorst,J.D. Pack +1 more
TLDR
In this article, a method for generating sets of special points in the Brillouin zone which provides an efficient means of integrating periodic functions of the wave vector is given, where the integration can be over the entire zone or over specified portions thereof.Abstract:
A method is given for generating sets of special points in the Brillouin zone which provides an efficient means of integrating periodic functions of the wave vector. The integration can be over the entire Brillouin zone or over specified portions thereof. This method also has applications in spectral and density-of-state calculations. The relationships to the Chadi-Cohen and Gilat-Raubenheimer methods are indicated.read more
Citations
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Journal ArticleDOI
Tuning the Electronic and Magnetic Properties of MoS2 Nanoribbons by Strain Engineering
Hui Pan,Yong-Wei Zhang +1 more
TL;DR: In this paper, the effects of strain on the electronic and magnetic properties of MoS2 nanoribbons were investigated and it was shown that they are stretchable up to a strain of 10%.
Journal ArticleDOI
Hydrated Intercalation for High-Performance Aqueous Zinc Ion Batteries
Journal ArticleDOI
Thermal physics of the lead chalcogenides PbS, PbSe, and PbTe from first principles
TL;DR: In this paper, a comparative lattice-dynamics study of the temperature dependence of the properties of PbS, PbSe, and PbTe, focusing particularly on those relevant to thermoelectric performance, is presented.
Journal ArticleDOI
The adsorption of H2O on TiO2 and SnO2(110) studied by first-principles calculations
Jacek Goniakowski,M. J. Gillan +1 more
TL;DR: In this paper, the energy properties of dissociative H2O adsorption on the (110) surface of TiO2 and SnO2 were investigated and the results of thermal desorption experiments were reported.
Journal ArticleDOI
Near room-temperature synthesis of transfer-free graphene films
Jinsung Kwak,Jae Hwan Chu,Jae-Kyung Choi,Soon-Dong Park,Heungseok Go,Sung Youb Kim,Kibog Park,Sung-Dae Kim,Young-Woon Kim,Euijoon Yoon,Suneel Kodambaka,Soon-Yong Kwon +11 more
TL;DR: A new method for the synthesis of graphene films directly on SiO(2)/Si substrates, even plastics and glass at close to room temperature (25-160 °C), which opens up new possibilities for the fabrication of multiple nanoelectronic devices.
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