Density-Functional Theory for Thermoelectric Phenomena

Project Information

ThermalDFT

Grant agreement ID: 701796

DOI

10.3030/701796

Project closed

EC signature date 4 March 2016

Start date 15 October 2016

End date 14 October 2018

Funded under

• EXCELLENT SCIENCE - Marie Skłodowska-Curie Actions

Total cost

€ 159 460,80

EU contribution

€ 159 460,80

Coordinated by

MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN EV
Germany

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Links to deliverables and publications from FP7 projects, as well as links to some specific result types such as dataset and software, are dynamically retrieved from OpenAIRE .

Publications

Peer reviewed articles (5)

Transient Charge and Energy Flow in the Wide-Band Limit

Author(s): F. Covito, F. G. Eich, R. Tuovinen, M. A. Sentef, A. Rubio
Published in: Journal of Chemical Theory and Computation, Issue 14/5, 2018, Page(s) 2495-2504, ISSN 1549-9618
Publisher: American Chemical Society
DOI: 10.1021/acs.jctc.8b00077

Kinetic-Energy Density-Functional Theory on a Lattice

Author(s): Iris Theophilou, Florian Buchholz, F. G. Eich, Michael Ruggenthaler, Angel Rubio
Published in: Journal of Chemical Theory and Computation, Issue 14/8, 2018, Page(s) 4072-4087, ISSN 1549-9618
Publisher: American Chemical Society
DOI: 10.1021/acs.jctc.8b00292

A shortcut to gradient-corrected magnon dispersion: exchange-only case

Author(s): Florian G. Eich, Stefano Pittalis, Giovanni Vignale
Published in: The European Physical Journal B, Issue 91/8, 2018, ISSN 1434-6028
Publisher: Springer Verlag
DOI: 10.1140/epjb/e2018-90253-y

Effective mass of quasiparticles from thermodynamics

Author(s): F. G. Eich, Markus Holzmann, G. Vignale
Published in: Physical Review B, Issue 96/3, 2017, ISSN 2469-9950
Publisher: American Physical Society
DOI: 10.1103/PhysRevB.96.035132

U ( 1 ) × SU ( 2 ) gauge invariance made simple for density functional approximations

Author(s): S. Pittalis, G. Vignale, F. G. Eich
Published in: Physical Review B, Issue 96/3, 2017, ISSN 2469-9950
Publisher: American Physical Society
DOI: 10.1103/physrevb.96.035141