Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations
The vibrational property of 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (HAT6) discotic liquid crystal (DLC) material is investigated in this research by using temperature-dependent Raman spectroscopy technique. One-dimensional (1D) charge transport mechanism in the DLC molecules is enabled in the c...
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my.um.eprints.208212019-04-08T03:37:35Z http://eprints.um.edu.my/20821/ Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations Sahamir, Shahrir Razey Said, Suhana Mohd Sabri, Mohd Faizul Mohd Mahmood, Mohamand Syafie Kamarudin, Muhammad Akmal Moutanabbir, Oussama TJ Mechanical engineering and machinery TK Electrical engineering. Electronics Nuclear engineering The vibrational property of 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (HAT6) discotic liquid crystal (DLC) material is investigated in this research by using temperature-dependent Raman spectroscopy technique. One-dimensional (1D) charge transport mechanism in the DLC molecules is enabled in the columnar liquid crystalline (Dh) phase. The result indicates a high core-to-core correlation in the liquid crystal columnar phase, which has a ‘memory’ like effect that extends into isotropic phase at femtosecond timescale. This correlation is also confirmed through electrical conductivity measurement of DLCs, in which the electrical conductivity is enhanced in the DLC phase. DFT simulation was also carried out in order to elucidate the basic properties of HAT6 such as the band gap in the light of Raman spectra. An interesting outcome is that a freely unspecified boundary model produces in a more flexible molecule, resulting in a reduced band gap. Thus, this work provides an understanding of relationship between columnar order and electrical conductivity of HAT6 molecule, and potential strategy for design of DLCs in electronics application. Taylor & Francis 2018 Article PeerReviewed Sahamir, Shahrir Razey and Said, Suhana Mohd and Sabri, Mohd Faizul Mohd and Mahmood, Mohamand Syafie and Kamarudin, Muhammad Akmal and Moutanabbir, Oussama (2018) Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations. Liquid Crystals, 45 (4). pp. 522-535. ISSN 0267-8292 https://doi.org/10.1080/02678292.2017.1359693 doi:10.1080/02678292.2017.1359693 |
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TJ Mechanical engineering and machinery TK Electrical engineering. Electronics Nuclear engineering Sahamir, Shahrir Razey Said, Suhana Mohd Sabri, Mohd Faizul Mohd Mahmood, Mohamand Syafie Kamarudin, Muhammad Akmal Moutanabbir, Oussama Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
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The vibrational property of 2,3,6,7,10,11-hexakis(hexyloxy)triphenylene (HAT6) discotic liquid crystal (DLC) material is investigated in this research by using temperature-dependent Raman spectroscopy technique. One-dimensional (1D) charge transport mechanism in the DLC molecules is enabled in the columnar liquid crystalline (Dh) phase. The result indicates a high core-to-core correlation in the liquid crystal columnar phase, which has a ‘memory’ like effect that extends into isotropic phase at femtosecond timescale. This correlation is also confirmed through electrical conductivity measurement of DLCs, in which the electrical conductivity is enhanced in the DLC phase. DFT simulation was also carried out in order to elucidate the basic properties of HAT6 such as the band gap in the light of Raman spectra. An interesting outcome is that a freely unspecified boundary model produces in a more flexible molecule, resulting in a reduced band gap. Thus, this work provides an understanding of relationship between columnar order and electrical conductivity of HAT6 molecule, and potential strategy for design of DLCs in electronics application. |
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Article |
author |
Sahamir, Shahrir Razey Said, Suhana Mohd Sabri, Mohd Faizul Mohd Mahmood, Mohamand Syafie Kamarudin, Muhammad Akmal Moutanabbir, Oussama |
author_facet |
Sahamir, Shahrir Razey Said, Suhana Mohd Sabri, Mohd Faizul Mohd Mahmood, Mohamand Syafie Kamarudin, Muhammad Akmal Moutanabbir, Oussama |
author_sort |
Sahamir, Shahrir Razey |
title |
Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
title_short |
Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
title_full |
Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
title_fullStr |
Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
title_full_unstemmed |
Studies on relation between columnar order and electrical conductivity in HAT6 discotic liquid crystals using temperature-dependent Raman spectroscopy and DFT calculations |
title_sort |
studies on relation between columnar order and electrical conductivity in hat6 discotic liquid crystals using temperature-dependent raman spectroscopy and dft calculations |
publisher |
Taylor & Francis |
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2018 |
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http://eprints.um.edu.my/20821/ https://doi.org/10.1080/02678292.2017.1359693 |
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1643691389621370880 |
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13.211869 |