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Civil Engineering Commons

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Technological University Dublin

2023

Density functional theory

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Full-Text Articles in Civil Engineering

Thermoelectric Properties Of Cement Composite Analogues From First Principles Calculations, Esther Orisakwe, Conrad S.N. Johnston, Ruchita Jani, Xiaolo Liu, Lorenzo Stella, Jorge Kohanoff's, Niall Holmes Dr., Brian Norton, Ming Qu, Hongxi Yin, Kazuaki Yazawa Jan 2023

Thermoelectric Properties Of Cement Composite Analogues From First Principles Calculations, Esther Orisakwe, Conrad S.N. Johnston, Ruchita Jani, Xiaolo Liu, Lorenzo Stella, Jorge Kohanoff's, Niall Holmes Dr., Brian Norton, Ming Qu, Hongxi Yin, Kazuaki Yazawa

Articles

Buildings are responsible for a considerable fraction of the energy wasted globally every year, and as a result, excess carbon emissions. While heat is lost directly in colder months and climates, resulting in increased heating loads, in hot climates cooling and ventilation is required. One avenue towards improving the energy efficiency of buildings is to integrate thermoelectric devices and materials within the fabric of the building to exploit the temperature gradient between the inside and outside to do useful work. Cement-based materials are ubiquitous in modern buildings and present an interesting opportunity to be functionalized. We present a systematic investigation …