Funding: The authors declare that they have no known competing financial interests or personal relationships that could have appeared to influence the work reported in this paper.
Conflicts of interest/Competing interests: We wish to confirm that there are no known conflicts of interest associated with this publication.
Availability of data and material: The authors confirm that the data supporting the findings of this study are available within the article.
Code availability:
data availability: all data underlying the results are available as part of the article and no additional source data are required.
Software code and availability from: https://gaussian.com/
Authors' contributions:
Conceptualization: formulation and evolution of overarching research goals an aims.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya, Youness Abdellaoui, Hicham Abou Oualid
Data curation: produce data, including software code use.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya, Miguel Reina
Investigation: performing the experiments.
Youness Abdellaoui, Issam Barra, Younes Brahmi, Hassan Bourzi
Formal analysis: analyze study data.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya, Youness Abdellaoui, Issam Barra, Younes Brahmi, Hassan Bourzi
Project administration: management and coordination responsibility for the research activity planning and execution.
Youness Abdellaoui, Hicham Abou Oualid
Resources: provision of study materials, reagents, laboratory simples, instrumentation computing resources; other analysis tools.
Christian A. Celaya, Youness Abdellaoui, Issam Barra, Younes Brahmi, Hassan Bourzi,
Software: implementation of the computer code and supporting algorithms.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya
Supervision: oversight and leadership responsibility for the research activity planning and execution, including mentorship external to the core team.
Youness Abdellaoui, Abdallah Albourine, Hicham Abou Oualid
Validation: verification, whether as a part of the activity or separate, of the overall replication or reproductivity of results/experiments and other research outputs.
Daniel G. Araiza, Youness Abdellaoui, Miguel Reina, Hicham Abou Oualid
Visualization: preparation, creation and/or presentation of the published work, specifically visualization/data presentation.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya, Youness Abdellaoui, Hicham Abou Oualid
Writing-original draft: preparation, creation and/or presentation of the published work, specifically writing the initial draft.
Mohammed Elhoudi, Rachid Oukhrib, Christian A. Celaya