Materials Map

Discover the materials research landscape. Find experts, partners, networks.

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The Materials Map is an open tool for improving networking and interdisciplinary exchange within materials research. It enables cross-database search for cooperation and network partners and discovering of the research landscape.

The dashboard provides detailed information about the selected scientist, e.g. publications. The dashboard can be filtered and shows the relationship to co-authors in different diagrams. In addition, a link is provided to find contact information.

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Materials Map under construction

The Materials Map is still under development. In its current state, it is only based on one single data source and, thus, incomplete and contains duplicates. We are working on incorporating new open data sources like ORCID to improve the quality and the timeliness of our data. We will update Materials Map as soon as possible and kindly ask for your patience.

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Godlevsky, Vitaliy V.

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in Cooperation with on an Cooperation-Score of 37%

Topics

Publications (1/1 displayed)

  • 2002First-principles simulations of liquid ZnTecitations

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Jain, Manish
1 / 14 shared
Chelikowsky, James R.
1 / 3 shared
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2002

Co-Authors (by relevance)

  • Jain, Manish
  • Chelikowsky, James R.
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article

First-principles simulations of liquid ZnTe

  • Jain, Manish
  • Chelikowsky, James R.
  • Godlevsky, Vitaliy V.
Abstract

<p>We report the results of ab initio molecular-dynamic simulations of liquid ZnTe near the melting point temperature. In agreement with experiment, we find that l-ZnTe retains its open tetrahedral environment upon melting with a coordination near four. In addition, we find atoms of Te in l-ZnTe often form transitory chains just as in l-CdTe. We compare our calculated structure factor to experiment and also determine the conductivity of the melt. l-ZnTe has a semiconductorlike conductivity similar to CdTe. We also calculate the dynamic properties of the liquid and predict self-diffusion constants of D<sub>Zn</sub> = 1.0 × 10<sup>-4</sup> cm<sup>2</sup>/s and D<sub>Te</sub> = 3.2 × 10<sup>-5</sup> cm<sup>2</sup>/s.</p>

Topics
  • experiment
  • simulation
  • melt