cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.7199891
title: Jardim Garcia quarry

description: This dataset is composed by an image set and a Digital Outcrop Model of the west side of the Jardim Garcia quarry, a ∼25 m high and ∼200 m long SSE-NNW rock wall. It belongs to a deactivated quarry situated at the outskirts of Campinas City (São Paulo State, southeastern Brazil), composed of mafic intrusive rocks from Serra Geral Formation (Cretaceous, Paraná Basin) and used as a recreational area for activities such as rock climbing and aeromodeling.


The images were acquired by a DJI Phantom 4 Pro. The automatic flight was programmed using Litchi App. For georeferencing the final 3D model, climbing anchors were surveyed by irradiation from a total station located in an open traverse. The traverse coordinates were obtained by geodetic GNSS post-processing.



	
d20m.zip is the original photo collection (539 images) acquired by a DJI Phantom 4 Pro at a 20 m distance from the outcrop
	
UH_UH_points.ply is a partial dense point cloud processed with 78 photos using Agisoft Metashape with align and densification parameters set to Ultra High
	
20m_UH_UH.pdf is the processing report for the partial point cloud
	
[v2 UPDATE] full_mesh.zip contains textured mesh (obj and ply formats) of the full dataset.
DOI: 10.5281/zenodo.7199892
title: Jardim Garcia quarry

description: This dataset is composed by an image set and part of a Digital Outcrop Model of the west side of the Jardim Garcia quarry, a ∼25 m high and ∼200 m long SSE-NNW rock wall. It belongs to a deactivated quarry situated at the outskirts of Campinas City (São Paulo State, southeastern Brazil), composed of mafic intrusive rocks from Serra Geral Formation (Cretaceous, Paraná Basin) and used as a recreational area for activities such as rock climbing and aeromodeling. The images were acquired by a DJI Phantom 4 Pro. The automatic flight was programmed using Litchi App. For georeferencing the final 3D model, climbing anchors were surveyed by irradiation from a total station located in an open traverse. The traverse coordinates were obtained by geodetic GNSS post-processing. <strong>d20m.zip</strong> is the original photo collection (539 images) acquired by a DJI Phantom 4 Pro at a 20 m distance from the outcrop <strong>UH_UH_points.ply</strong> is the partial dense point cloud processed with 78 photos using Agisoft Metashape with align and densification parameters set to Ultra High <strong>20m_UH_UH.pdf</strong> is the processing report for the partial point cloud.
description: {"references": ["Grohmann, C.H.; Viana, C.D.; Garcia, G.P.B; Albuquerque, R.W.; Barale, F.; Ferretti, F.A., 2019. Semi-Automatic UAV-based SfM survey of vertical surfaces. XIX Brazilian Symposium on Remote Sensing. Santos, SP. https://proceedings.science/sbsr-2019/papers/semi-automatic-uav-based-sfm-survey-of-vertical-surfaces", "Viana, C.D., Monticelli, J.P., Grohmann, C.H., Garcia, G.P.B., Albuquerque, R.W., Cacciari, P.P., and Futai, M.M., 2019, Slope stability assessment based on a digital outcrop model: A case-study at Jardim Garcia quarry, in Fontoura, S.A.B., Rocca, R.J., and Mendoza, J.P. eds., Rock Mechanics for Natural Resources and Infrastructure Development - Full Papers: Proceedings of the 14th International Congress on Rock Mechanics, Foz do Iguassu, CRC Press, p. 3604\u20133611.", "Viana, C.D., 2021. Fotogrametria digital multi-escala para aquisi\u00e7\u00e3o de dados estruturais. https://www.teses.usp.br/teses/disponiveis/44/44137/tde-18012022-122057/pt-br.php"]}
DOI: 10.5281/zenodo.7220755
title: Jardim Garcia quarry

description: This dataset is composed by an image set and a Digital Outcrop Model of the west side of the Jardim Garcia quarry, a ∼25 m high and ∼200 m long SSE-NNW rock wall. It belongs to a deactivated quarry situated at the outskirts of Campinas City (São Paulo State, southeastern Brazil), composed of mafic intrusive rocks from Serra Geral Formation (Cretaceous, Paraná Basin) and used as a recreational area for activities such as rock climbing and aeromodeling.


The images were acquired by a DJI Phantom 4 Pro. The automatic flight was programmed using Litchi App. For georeferencing the final 3D model, climbing anchors were surveyed by irradiation from a total station located in an open traverse. The traverse coordinates were obtained by geodetic GNSS post-processing.



	
d20m.zip is the original photo collection (539 images) acquired by a DJI Phantom 4 Pro at a 20 m distance from the outcrop
	
UH_UH_points.ply is a partial dense point cloud processed with 78 photos using Agisoft Metashape with align and densification parameters set to Ultra High
	
20m_UH_UH.pdf is the processing report for the partial point cloud
	
[v2 UPDATE] full_mesh.zip contains textured mesh (obj and ply formats) of the full dataset.
DOI: 10.18112/openneuro.ds004927.v1.0.0
title: Auditory Tones
DOI: 10.5281/zenodo.10522514
title: THE SYSTEM OF CLUSTERS IN OUR COUNTRY AND WAYS TO IMPROVE IT
DOI: 10.5281/zenodo.10522515
title: THE SYSTEM OF CLUSTERS IN OUR COUNTRY AND WAYS TO IMPROVE IT
DOI: 10.34740/kaggle/dsv/7420527
title: YouTube Trending Video Dataset (updated daily)
DOI: 10.5281/zenodo.10522496
title: Diffusion in porous rocks is anomalous

description: The normalized concentration datasets for fice rocks samples used to study anomalous diffusion of conservative bromide tracer.
DOI: 10.5281/zenodo.10522497
title: Diffusion in porous rocks is anomalous

description: The normalized concentration datasets for fice rocks samples used to study anomalous diffusion of conservative bromide tracer.
DOI: 10.6084/m9.figshare.25008662
title: DuckeFungi_ASV_dist_ID_function_20220825.xlsx

description: High tree species diversity in tropical rain forests and rainfall seasonality contribute to large spatio-temporal variability in available resources for soil microbial communities. How the contribution of deterministic vs. stochastic processes to the assembly of these communities varies in space and time remains yet to be quantified so that soil microbial community responses to climate change may be projected.To address this knowledge gap, we characterised the spatio-temporal composition of soil fungal communities from the plot to the stand scales in a topographically homogeneous area in a tropical rain forest in central Amazonia. Doing so, we excluded obvious environmental gradients so as not to mask the detectability of potential mechanisms of community assembly linked to the intrinsic tree diversity of tropical rain forests. We then related fungal communities to seasonal patterns and spatial variability in geographic and soil characteristics.Soil fungal communities showed a greater turnover in space than in time. The relative contribution of stochastic and deterministic processes to community assembly was related to season, with stochastic processes, including potential dispersal limitation and ecological drift dominating in the rainy season, and deterministic processes, such as speciesselection dominating in the dry season. The results indicate that seasonality is likely to be related to the temporary accumulation of tree species-specific litter during the litterfall peak in the dry season, could define a deterministic environment that fades away after the start of the rainy season.Our study highlights the importance of spatial heterogeneity in the absence of environmental gradients and its relationship with seasonal patterns that modulate spatial heterogeneity and contribute to environmental determinism vs. stochasticity for fungal community assembly in tropical rain forests. This baseline may serve for assessing deviations in community patterns caused by changes in biotic interactions with above-ground vegetation, such as those resulting from shifts in taxonomical/functional composition of trees driven by climate change.
DOI: 10.5281/zenodo.10522538
title: PECULIARITIES OF INNOVATIVE ACTIVITY IN THE EDUCATION SYSTEM OF UZBEKISTAN
DOI: 10.5281/zenodo.10522539
title: PECULIARITIES OF INNOVATIVE ACTIVITY IN THE EDUCATION SYSTEM OF UZBEKISTAN
DOI: 10.5281/zenodo.8355736
title: Dryfilm-ATR-FTIR analysis of urinary profiles as a point-of-care tool to evaluate aerobic exercise

description: This dataset encompasses spectral raw data, accompanying metadata, and a MATLAB live script detailing the data analysis workflow presented in the paper titled "Dryfilm-ATR-FTIR analysis of urinary profiles as a point-of-care tool to evaluate aerobic exercise". The study explores the non-invasive analysis of urine composition using attenuated total reflectance-Fourier transform infrared (ATR-FTIR) spectroscopy coupled with multivariate analysis as a rapid and cost-effective method to investigate metabolic changes after intense exercise.
description: We would like to thank the participants for their voluntary participation in this study. J.B. acknowledges financial support from the INVESTIGO program (INVEST/2022/95) funded by the Next Generation EU. Á.S.I. acknowledges the support of Margarita Salas grant (UP2021-044-MS21-084) from the Ministry of Universities of the Government of Spain, financed by the European Union, NextGeneration EU. D.P-G. acknowledges the financial support from the projects RYC2019-026556-I and RPID2020-119326RA-I00 funded by MCIN/AEI/10.13039/501100011033. J.P.Q acknowledges the “Grupos Emergentes” funding by Conselleria de Innovación, Universidades, Ciencia y Sociedad Digital de la Generalitat Valenciana [GV/2020/050].
DOI: 10.5281/zenodo.8355737
title: Dryfilm-ATR-FTIR analysis of urinary profiles as a point-of-care tool to evaluate aerobic exercise

description: This dataset encompasses spectral raw data, accompanying metadata, and a MATLAB live script detailing the data analysis workflow presented in the paper titled "Dryfilm-ATR-FTIR analysis of urinary profiles as a point-of-care tool to evaluate aerobic exercise". The study explores the non-invasive analysis of urine composition using attenuated total reflectance-Fourier transform infrared (ATR-FTIR) spectroscopy coupled with multivariate analysis as a rapid and cost-effective method to investigate metabolic changes after intense exercise.
description: We would like to thank the participants for their voluntary participation in this study. J.B. acknowledges financial support from the INVESTIGO program (INVEST/2022/95) funded by the Next Generation EU. Á.S.I. acknowledges the support of Margarita Salas grant (UP2021-044-MS21-084) from the Ministry of Universities of the Government of Spain, financed by the European Union, NextGeneration EU. D.P-G. acknowledges the financial support from the projects RYC2019-026556-I and RPID2020-119326RA-I00 funded by MCIN/AEI/10.13039/501100011033. J.P.Q acknowledges the “Grupos Emergentes” funding by Conselleria de Innovación, Universidades, Ciencia y Sociedad Digital de la Generalitat Valenciana [GV/2020/050].
DOI: 10.17037/data.00003742
title: Cross sectional survey data for self-reported ever and recent (last 12 months) STI testing

description: Data collected as part of a self-reported survey on sexual behaviour and sexually transmitted infection (STI) testing. The cross-sectional survey was conducted with adolescents and young people aged 15 to 24 in two communities of Lusaka, Zambia.
description: Data collected using cross sectional survey. Restricting data to variables included in the analysis; renaming variables and labelling; deriving some variables from the raw data (for example, age grouped into two categories and educational attainment derived from variable on highest level of education completed).
DOI: 10.34808/ree1-6105
title: XRD-Ni  foam as received and oxidised at 500_C

description: These data contain XRD patterns of porous nickel foam commercial and oxidised in air at 500 C degrees for 8 hours.
DOI: 10.5258/soton/d2932
title: Dataset for "Experimental investigation of scalar dispersion in indoor spaces"

description: Data supports: H.D. Lim, Timothy G. Foat, Simon T. Parker, Christina Vanderwel, Experimental investigation of scalar dispersion in indoor spaces, Building and Environment, 2024, 111167, ISSN 0360-1323,
https://doi.org/10.1016/j.buildenv.2024.111167.
(https://www.sciencedirect.com/science/article/pii/S036013232400009X)

This dataset contains PIV-PLIF experimental data in the folder. Readme files are provided in the zip folder explaining the data fields and how to interpret them. The data files are in .mat format.
DOI: 10.5281/zenodo.10522547
title: SIYOSIY DISKURSNING LINGVISTIK TAHLILI (B.OBAMANING INAGURATSIYA NUTQI MISOLIDA)
DOI: 10.5281/zenodo.10522548
title: SIYOSIY DISKURSNING LINGVISTIK TAHLILI (B.OBAMANING INAGURATSIYA NUTQI MISOLIDA)
DOI: 10.5281/zenodo.8337900
title: DFT Calculated xyz in Support of "Computational Modelling and Mechanistic Insight into Light-driven CO Dissociation of square-planar Rh(I) Complexes"

description: The C-H activation of alkanes mediated by electron-rich metal complexes, such as Rh(I) complexes, has drawn considerable attention in recent decades. In order to interact with the C-H bond, most Rh complexes, such as trans-Rh(PMe3)2(CO)(Cl) need to be activated through irradiation, which leads to the photocleavage of the Rh-CO bond and the formation of the active species Rh(PMe3)2(Cl). To elucidate the details of the photochemistry of trans-Rh(PMe3)2(CO)(Cl), we here present a computationally derived picture as obtained at the density functional level of theory (DFT) in combination with multireference wavefunction-based methods. We have identified that the photocleavage of CO proceeds via the metal-centered excited state, which is populated through intersystem crossing (ISC) from the dipole-allowed excited state S1. Moreover, the present study unraveled the reasons for the low C-H activation efficiency when using Rh featuring the bidentate ligand 1,2-bis(dimethylphosphino)ethane (dmpe), namely due to its unfavorable photochemical properties, i.e., the small driving force for light-induced CO loss and the fast deactivation of 3MC state back to the singlet ground state. In this study, we provide theoretical insight into mechanistic details underlying the light-induced CO dissociation process, for Rh complexes featuring PMe3 and dmpe ligands.
description: T.H. and S.G. gratefully acknowledge funding from Carl-Zeiss-Stiftung "Durchbrüche". R.G. gratefully acknowledges funding from the "Bund-Länder Tenure-Track Programm" of the Federal Ministry of Education and Research (BMBF) as well as by an accompanying grant from the Free State of Thuringia (FKZ: 16TTP133). Furthermore, funding by the Deutsche Forschungsgemeinschaft (German Research Foundation) via the TRR CATALIGHT, Projektnummer 364549901 (C5), TRR234 is gratefully acknowledged. All calculations were performed at the Universitätsrechenzentrum of the Friedrich Schiller University of Jena.
DOI: 10.5281/zenodo.8337901
title: DFT Calculated xyz in Support of "Computational Modelling and Mechanistic Insight into Light-driven CO Dissociation of square-planar Rh(I) Complexes"

description: The C-H activation of alkanes mediated by electron-rich metal complexes, such as Rh(I) complexes, has drawn considerable attention in recent decades. In order to interact with the C-H bond, most Rh complexes, such as trans-Rh(PMe3)2(CO)(Cl) need to be activated through irradiation, which leads to the photocleavage of the Rh-CO bond and the formation of the active species Rh(PMe3)2(Cl). To elucidate the details of the photochemistry of trans-Rh(PMe3)2(CO)(Cl), we here present a computationally derived picture as obtained at the density functional level of theory (DFT) in combination with multireference wavefunction-based methods. We have identified that the photocleavage of CO proceeds via the metal-centered excited state, which is populated through intersystem crossing (ISC) from the dipole-allowed excited state S1. Moreover, the present study unraveled the reasons for the low C-H activation efficiency when using Rh featuring the bidentate ligand 1,2-bis(dimethylphosphino)ethane (dmpe), namely due to its unfavorable photochemical properties, i.e., the small driving force for light-induced CO loss and the fast deactivation of 3MC state back to the singlet ground state. In this study, we provide theoretical insight into mechanistic details underlying the light-induced CO dissociation process, for Rh complexes featuring PMe3 and dmpe ligands.
description: T.H. and S.G. gratefully acknowledge funding from Carl-Zeiss-Stiftung "Durchbrüche". R.G. gratefully acknowledges funding from the "Bund-Länder Tenure-Track Programm" of the Federal Ministry of Education and Research (BMBF) as well as by an accompanying grant from the Free State of Thuringia (FKZ: 16TTP133). Furthermore, funding by the Deutsche Forschungsgemeinschaft (German Research Foundation) via the TRR CATALIGHT, Projektnummer 364549901 (C5), TRR234 is gratefully acknowledged. All calculations were performed at the Universitätsrechenzentrum of the Friedrich Schiller University of Jena.
DOI: 10.5281/zenodo.8260783
title: Ilm-NMR-P31

description: This publication introduces a novel open-access 31P Nuclear Magnetic Resonance (NMR) shift database designed to bridge the gap between commercial and open-access resources. With 14,250 entries encompassing 13,730 distinct molecules from 3,648 references, this database offers a comprehensive repository of organic and inorganic compounds. Emphasizing single-phosphorus atom compounds, the database facilitates data mining and machine learning endeavors, particularly in signal prediction and Computer-Assisted Structure Elucidation (CASE) systems.
 
The dataset is available in 3 different formats:

The molecular structures are available as either a single large SDF file, which includes all database information or as multiple smaller SDF (Structure Data Format) files, where each SDF file lists the information for one molecule. The NMR data is stored in the tag section of the SDF files in the format proposed by the NMReData initiative (http://nmredata.org/, V1.1). This includes the 31P shift the solvent, where available.
The data is also available as CSV file. The file does not contain the molecular structures but rather lists important information (sum formula, 31P shift, solvent, molecular weight, number of carbon, nitrogen, phosphorous and oxygen atoms) of which the most important is the canonical SMILES string generated by OpenBabel V3.1.1.
The same information as in the CSV and SDF files is also available in a RDA file, which is the R Data Format for the script language R (https://www.r-project.org/). The data is stored as a "tibble" (https://tibble.tidyverse.org/) which is a special data frame format in R.
description: The project was funded by the "Bund-Länder Tenure-Track Programm" of the Federal Ministry of Education and Research (BMBF; FKz.: 16TTP133) as well as by an accompanying grant from the Free State of Thuringia.
DOI: 10.57967/hf/1508
title: festcat_trimmed_denoised
DOI: 10.57967/hf/1651
title: festcat_trimmed_denoised
DOI: 10.5281/zenodo.6865896
title: DFT Calculated xyz Files in Support of "Bidentate Rh(I)-Phosphine Complexes for the C-H Activation of Alkanes: Computational Modelling and Mechanistic Insight"

description: Theoretically calculated xyz files for propane, carbon monoxide, butyraldehyde and multiple Rh-phosphine complexes as well as transition states relevant for the C-H activation and subsequent carbonylation of alkanes.


All quantum chemical simulations were performed using the Gaussian 16 software package. Closed-shell equilibrium structures, i.e., minima and transition states (TSs) as well as electronic properties of educts, intermediates, and products involved in the C-H activation of propane (methyl group activation) and subsequent steps mediated by the Rh complexes were obtained at the DFT level of theory. The range-separated B97XD functional was employed. The def2-SVP basis set and the respective effective core potential (ECP) were utilized for all atoms. TSs were fully optimized at the same level of theory using the rational function optimization (RFO) approach as well as nudged elastic band (NEB) method as implemented in the pysisyphus software suite. Subsequently, a vibrational analysis was carried out for each stationary point to verify that a minimum or first-order saddle point was obtained on the 3N-6-dimensional potential energy (hyper)surface (PES).
DOI: 10.5281/zenodo.6865897
title: DFT Calculated xyz Files in Support of "Bidentate Rh(I)-Phosphine Complexes for the C-H Activation of Alkanes: Computational Modelling and Mechanistic Insight"

description: Theoretically calculated xyz files for propane, carbon monoxide, butyraldehyde and multiple Rh-phosphine complexes as well as transition states relevant for the C-H activation and subsequent carbonylation of alkanes.


All quantum chemical simulations were performed using the Gaussian 16 software package. Closed-shell equilibrium structures, i.e., minima and transition states (TSs) as well as electronic properties of educts, intermediates, and products involved in the C-H activation of propane (methyl group activation) and subsequent steps mediated by the Rh complexes were obtained at the DFT level of theory. The range-separated B97XD functional was employed. The def2-SVP basis set and the respective effective core potential (ECP) were utilized for all atoms. TSs were fully optimized at the same level of theory using the rational function optimization (RFO) approach as well as nudged elastic band (NEB) method as implemented in the pysisyphus software suite. Subsequently, a vibrational analysis was carried out for each stationary point to verify that a minimum or first-order saddle point was obtained on the 3N-6-dimensional potential energy (hyper)surface (PES).
DOI: 10.60893/figshare.jap.24860007
title: Supplemental 1

description: See document
DOI: 10.60893/figshare.jap.24860007.v1
title: Supplemental 1

description: See document
DOI: 10.48323/vde60-t4708
title: DIGIdat - Long Term Air Quality Measurements in Austrian Schools - Phase1 Dataset

description: Long Term Air Quality Measurements in Austrian Schools - Phase1 Dataset
Project DIGIdat - University of Innsbruck
Funded by Austrian Agency for Education and Internationalisation (OEAD) and Federal Ministry of Education, Science and Research Austria (BMBWF)
 
This dataset contains timeseries of air quality measurements in Austrian schools.
 
Date Range: Dec. 2022 to Apr. 2023
Sensor Kit: SenseBox in 3D-printed Housing (SenseBox:mini MCU v2, OLED-Display, WiFi-Bee, microSD)
Sensor Types: BME680, SCD30, SPS30
DOI: 10.5281/zenodo.10522076
title: Marine Strontium Isotope Evolution at the Triassic-Jurassic Transition Links Transient Changes in Continental Weathering to Volcanism of the Central Atlantic Magmatic Province
DOI: 10.5281/zenodo.10522075
title: Marine Strontium Isotope Evolution at the Triassic-Jurassic Transition Links Transient Changes in Continental Weathering to Volcanism of the Central Atlantic Magmatic Province
DOI: 10.5281/zenodo.10522586
title: Flight of Insects

description: First, honeycombs are examined and it is proved that a thermal energy flow pulsates above them and this explains some of the properties of honeycombs. Since they are a special case of cavity structures, the last statement applies to all flat cavity structures (FPS). It is further shown that if the FPS begins to move, then Coriolis forces appear, which lift and accelerate the movement of the FPS. It is shown that the heat flow over the FPS and Coriolis forces are created by the gravitational energy of the Earth.
DOI: 10.5281/zenodo.10522587
title: Flight of Insects

description: First, honeycombs are examined and it is proved that a thermal energy flow pulsates above them and this explains some of the properties of honeycombs. Since they are a special case of cavity structures, the last statement applies to all flat cavity structures (FPS). It is further shown that if the FPS begins to move, then Coriolis forces appear, which lift and accelerate the movement of the FPS. It is shown that the heat flow over the FPS and Coriolis forces are created by the gravitational energy of the Earth.