Log in

Relevant bibliographies by topics / DFT approach

Contents

Journal articles

Academic literature on the topic 'DFT approach'

Author: Grafiati

Published: 18 May 2024

Create a spot-on reference in APA, MLA, Chicago, Harvard, and other styles

Select a source type:

Consult the lists of relevant articles, books, theses, conference reports, and other scholarly sources on the topic 'DFT approach.'

Next to every source in the list of references, there is an 'Add to bibliography' button. Press on it, and we will generate automatically the bibliographic reference to the chosen work in the citation style you need: APA, MLA, Harvard, Chicago, Vancouver, etc.

You can also download the full text of the academic publication as pdf and read online its abstract whenever available in the metadata.

Journal articles on the topic "DFT approach"

1

Hassan, Thowayeb H., Amany E. Salem, and Mahmoud I. Saleh. "Digital-Free Tourism Holiday as a New Approach for Tourism Well-Being: Tourists’ Attributional Approach." International Journal of Environmental Research and Public Health 19, no. 10 (2022): 5974. http://dx.doi.org/10.3390/ijerph19105974.

Full text

Abstract:

Digital-free tourism (DFT) has recently attracted tourism service providers’ attention for its benefits in terms of enhancing tourists’ experiences and well-being at destinations. DFT refers to tourists who are likely to voluntarily avoid digital devices and the Internet on holiday, or travel to destinations without network signals. DFT has advantages for tourists in increasing well-being, mental health, and social networking during their journeys. DFT also has a benefit for tourism marketers in that they can consider it as a new tourism approach. However, there is a lack of studies into touri

APA, Harvard, Vancouver, ISO, and other styles

2

Mathew, Ben, and Daniel G. Saab. "Partial Reset: An Alternative DFT Approach." VLSI Design 1, no. 4 (1994): 299–311. http://dx.doi.org/10.1155/1994/31646.

Full text

Abstract:

Design for testability (DFT) techniques reduce testing costs at the price of extra hardware. Among the many DFT techniques that have been proposed for this task are full scan, partial scan and hardware reset. In this paper we explore a relatively new DFT method, called partial reset. Reset lines are added to only a subset of the flip-flops and obtain reasonably high coverage. This approach has lower overhead in terms of test application time and hardware area when compared to previous ones. Further enhancement of the controllability is obtained by using multiple reset lines. The configuration

APA, Harvard, Vancouver, ISO, and other styles

3

Turkowski, Volodymyr, Alamgir Kabir, Neha Nayyar, and Talat S. Rahman. "A DFT + DMFT approach for nanosystems." Journal of Physics: Condensed Matter 22, no. 46 (2010): 462202. http://dx.doi.org/10.1088/0953-8984/22/46/462202.

Full text

APA, Harvard, Vancouver, ISO, and other styles

4

Ju, Xue-Hai, He-Ming Xiao, and Li-Tao Chen. "Periodic DFT approach to benzotrifuroxan crystal." International Journal of Quantum Chemistry 102, no. 2 (2005): 224–29. http://dx.doi.org/10.1002/qua.20362.

Full text

APA, Harvard, Vancouver, ISO, and other styles

5

Wilbraham, Liam, François-Xavier Coudert, and Ilaria Ciofini. "Modelling photophysical properties of metal–organic frameworks: a density functional theory based approach." Physical Chemistry Chemical Physics 18, no. 36 (2016): 25176–82. http://dx.doi.org/10.1039/c6cp04056j.

Full text

APA, Harvard, Vancouver, ISO, and other styles

6

Javid, H., S. A. Aldaghfag, M. K. Butt, et al. "Physical characteristics of LaCrxAl1-xO3: DFT approach." Journal of Ovonic Research 18, no. 4 (2022): 481–89. http://dx.doi.org/10.15251/jor.2022.184.481.

Full text

Abstract:

"The magnetic, electronic, and optical properties of Cr doped LaAlO3 are examined by Full Potential linearized augmented plane wave (FP-LAPW) method within Density functional theory (DFT). The pure compound (LaAlO3) is doped with different concentrations of chromium (Cr) to examine the doping effects on its characteristics. The calculations of band structure (BS) and density of states show Cr has major contribution while La, Al and O atoms have little involvement in the states near Fermi level. The magnetic features revealed that Cr plays major participation in ferromagnetic nature of LaCrxAl1

APA, Harvard, Vancouver, ISO, and other styles

7

Khoo, Khoong Hong, and Robert Laskowski. "A perturbative DFT approach for magnetic anisotropy." Journal of Magnetism and Magnetic Materials 428 (April 2017): 246–49. http://dx.doi.org/10.1016/j.jmmm.2016.12.037.

Full text

APA, Harvard, Vancouver, ISO, and other styles

8

Ju, Xue-Hai, He-Ming Xiao, and Qi-Ying Xia. "A periodic DFT approach to octanitrocubane crystal." Chemical Physics Letters 382, no. 1-2 (2003): 12–18. http://dx.doi.org/10.1016/j.cplett.2003.09.144.

Full text

APA, Harvard, Vancouver, ISO, and other styles

9

Sarkar, U., D. R. Roy, P. K. Chattaraj, R. Parthasarathi, J. Padmanabhan, and V. Subramanian. "A conceptual DFT approach towards analysing toxicity." Journal of Chemical Sciences 117, no. 5 (2005): 599–612. http://dx.doi.org/10.1007/bf02708367.

Full text

APA, Harvard, Vancouver, ISO, and other styles

10

Arya, B., P. Sachidanandan, and V. M. AnandaKumar. "Structural parameters of amphetamine: A DFT approach." Research Journal of Chemistry and Environment 28, no. 2 (2023): 86–99. http://dx.doi.org/10.25303/282rjce86099.

Full text

Abstract:

The structural parameters of Amphetamine, a significant psychoactive drug, are investigated experimentally and computationally using spectroscopic and DFT methods. The molecule is subjected to optimization using the B3LYP functional with both 6-311+G (2d,p) and augmented cc-pVTZ basis sets. Resulting values are then compared against published crystal data for validation. Analysis of the Fourier Transform Infrared and Raman spectra is carried out with PED assignments and after scaling, the calculated spectral frequency values are verified with experimental spectra, revealing a favorable match b

APA, Harvard, Vancouver, ISO, and other styles

More sources

We offer discounts on all premium plans for authors whose works are included in thematic literature selections. Contact us to get a unique promo code!