cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1738948
title: Materials Data on Li2Mn3(BO3)3 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1738949
title: Materials Data on Ba2BiIrO6 by Materials Project

description: Ba2BiIrO6 is Orthorhombic Perovskite-derived structured and crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Ba2+ is bonded in a 12-coordinate geometry to twelve O2- atoms. There are a spread of Ba–O bond distances ranging from 2.77–3.36 Å. Ir5+ is bonded to six O2- atoms to form IrO6 octahedra that share corners with six equivalent BiO6 octahedra. The corner-sharing octahedra tilt angles range from 11–17°. There are two shorter (2.00 Å) and four longer (2.01 Å) Ir–O bond lengths. Bi3+ is bonded to six O2- atoms to form BiO6 octahedra that share corners with six equivalent IrO6 octahedra. The corner-sharing octahedra tilt angles range from 11–17°. There are two shorter (2.32 Å) and four longer (2.33 Å) Bi–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to four equivalent Ba2+, one Ir5+, and one Bi3+ atom. In the second O2- site, O2- is bonded in a 4-coordinate geometry to four equivalent Ba2+, one Ir5+, and one Bi3+ atom. In the third O2- site, O2- is bonded in a 5-coordinate geometry to four equivalent Ba2+, one Ir5+, and one Bi3+ atom.
DOI: 10.17188/1738950
title: Materials Data on LiNiP2O7 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1738951
title: Materials Data on MnIn2NiO6 by Materials Project

description: In2NiMnO6 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Mn2+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with six equivalent NiO6 octahedra. The corner-sharing octahedra tilt angles range from 37–41°. There are a spread of Mn–O bond distances ranging from 1.93–1.98 Å. Ni4+ is bonded to six O2- atoms to form NiO6 octahedra that share corners with six equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 37–41°. There are a spread of Ni–O bond distances ranging from 2.04–2.13 Å. In3+ is bonded in a 4-coordinate geometry to eight O2- atoms. There are a spread of In–O bond distances ranging from 2.17–2.82 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to one Mn2+, one Ni4+, and two equivalent In3+ atoms to form distorted corner-sharing OMnIn2Ni trigonal pyramids. In the second O2- site, O2- is bonded in a 5-coordinate geometry to one Mn2+, one Ni4+, and three equivalent In3+ atoms. In the third O2- site, O2- is bonded in a 4-coordinate geometry to one Mn2+, one Ni4+, and three equivalent In3+ atoms.
DOI: 10.17188/1738952
title: Materials Data on CsTlF4 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1738953
title: Materials Data on Li4Co3Ni3(SbO8)2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1738954
title: Materials Data on GaNiO3 by Materials Project

description: NiGaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ni3+ is bonded to six equivalent O2- atoms to form NiO6 octahedra that share corners with six equivalent NiO6 octahedra and faces with eight equivalent GaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ni–O bond lengths are 1.84 Å. Ga3+ is bonded to twelve equivalent O2- atoms to form GaO12 cuboctahedra that share corners with twelve equivalent GaO12 cuboctahedra, faces with six equivalent GaO12 cuboctahedra, and faces with eight equivalent NiO6 octahedra. All Ga–O bond lengths are 2.60 Å. O2- is bonded in a distorted linear geometry to two equivalent Ni3+ and four equivalent Ga3+ atoms.
DOI: 10.17188/1738955
title: Materials Data on MgMn2O3 by Materials Project

description: MgMn2O3 is Caswellsilverite-like structured and crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Mg2+ is bonded to six equivalent O2- atoms to form MgO6 octahedra that share corners with six equivalent MnO6 octahedra, edges with six equivalent MgO6 octahedra, and edges with six equivalent MnO6 octahedra. The corner-sharing octahedral tilt angles are 3°. All Mg–O bond lengths are 2.16 Å. Mn2+ is bonded to six O2- atoms to form MnO6 octahedra that share corners with three equivalent MgO6 octahedra, corners with three equivalent MnO6 octahedra, edges with three equivalent MgO6 octahedra, and edges with nine equivalent MnO6 octahedra. The corner-sharing octahedra tilt angles range from 0–3°. There are three shorter (2.24 Å) and three longer (2.25 Å) Mn–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to three equivalent Mg2+ and three equivalent Mn2+ atoms to form a mixture of corner and edge-sharing OMg3Mn3 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second O2- site, O2- is bonded to six equivalent Mn2+ atoms to form a mixture of corner and edge-sharing OMn6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1738956
title: Materials Data on V4Bi3 by Materials Project

description: V4Bi3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are five inequivalent V sites. In the first V site, V is bonded in a 12-coordinate geometry to eight V and four Bi atoms. There are four shorter (2.56 Å) and four longer (2.92 Å) V–V bond lengths. There are two shorter (2.76 Å) and two longer (2.94 Å) V–Bi bond lengths. In the second V site, V is bonded to six Bi atoms to form edge-sharing VBi6 octahedra. There are a spread of V–Bi bond distances ranging from 2.72–2.86 Å. In the third V site, V is bonded in a 6-coordinate geometry to one V and six Bi atoms. The V–V bond length is 2.77 Å. There are a spread of V–Bi bond distances ranging from 2.80–2.93 Å. In the fourth V site, V is bonded in a 10-coordinate geometry to five V and five Bi atoms. There are one shorter (2.42 Å) and one longer (2.53 Å) V–V bond lengths. There are a spread of V–Bi bond distances ranging from 2.91–3.17 Å. In the fifth V site, V is bonded in a 9-coordinate geometry to four V and five Bi atoms. There are a spread of V–Bi bond distances ranging from 2.94–3.18 Å. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded to six V atoms to form distorted corner-sharing BiV6 octahedra. The corner-sharing octahedral tilt angles are 85°. In the second Bi site, Bi is bonded in a 6-coordinate geometry to six V atoms. In the third Bi site, Bi is bonded in a 7-coordinate geometry to seven V atoms. In the fourth Bi site, Bi is bonded in a 8-coordinate geometry to eight V atoms.
DOI: 10.6084/m9.figshare.13686166
title: The number of offspring produced by female Drosophila simulans over 4 days following artificial transinfection of Spiroplasma, compared to uninfected controls.

description: <b>Description of data</b>: The dataset is a record of the number of adult offspring produced by F2 Spiroplasma-transinfected and -uninfected females. For each day there is a record of the number of males and females that emerged, followed by the total number of flies emerged. The D. simulans strain used was F15, which is infected with Wolbachia. Data is in xlsl format. <br><br><b>Description of methods for data collection</b>: Microinjections were carried out as described by Nakayama et al, 2015. The number of adult offspring produced by the F2 generation of infected parental females was counted. Each F2 female was placed with two uninfected males in a vial of fly medium to mate. They were moved into fresh vials every day for five days to allow continuous oviposition. On the sixth day, adult flies were removed, and the females were screened for Spiroplasma. The eclosed offspring from days 2 to 5 were counted. <br><br><b>Column headings</b>:<br><b>Column A</b>- Group: Independent D. simulans lines with alternative nomenclature (a, b, c and d) for easy ordering in R.<br><b>Column B</b>- Line: Independent D. simulans lines (b, c1 and c2) derived from successfully transinfected females and an uninfected control (control).<br><b>Column C</b>- Infection.status: Spiroplasma infection status of D. simulans. Infected (I) and not infected (NI).<br><b>Column D</b>- Block: Spiroplasma infection status of D. simulans. Spiroplasma positive (S+) and Spiroplasma negative (S-).<br><b>Column E</b>- Genotype: lineage (g, i, j, k, c, e, b, d, h and f) of F2 mothers.<br><b>Column F</b>- Rep: replicate female F2 D. melanogaster<br><b>Column G</b>- D2M: adult males from the second day of the fecundity assay<br><b>Column H</b>- D2F: adult females from the second day of the fecundity assay<br><b>Column I</b>- D2T: total number of males and females from the second day of the fecundity assay<br><b>Column J</b>- D3M: adult males from the third day of the fecundity assay<br><b>Column K</b>- D3F: adult females from the third day of the fecundity assay<br><b>Column L</b>- D3T: total number of males and females from the third day of the fecundity assay <br><b>Column M</b>- D4M: adult males from the fourth day of the fecundity assay<br><b>Column N</b>- D4F: adult females from the fourth day of the fecundity assay <br><b>Column O</b>- D4T: total number of males and females from the fourth day of the fecundity assay<br><b>Column P</b>- D5M: adult males from the fifth day of the fecundity assay <br><b>Column Q</b>- D5F: adult females from the fifth day of the fecundity assay<b>Total</b>: total number of adult flies produced from each female Spiroplasma-infected and -uninfected D. simulans.<br><br>
DOI: 10.6084/m9.figshare.13686169
title: The number of offspring produced by female Drosophila melanogaster over 4 days following artificial transinfection of Spiroplasma, compared to uninfected controls.

description: <b>Description of data</b>: The dataset is a record of the number of adult offspring produced by F2 Spiroplasma-transinfected and -uninfected females. For each day there is a record of the number of males and females that emerged, followed by the total number of flies emerged. The D. melanogaster strain used was Canton S, which is infected with Wolbachia. Data is in xlsl format.<br><br><b>Description of methods for data collection</b>: Microinjections were carried out as described by Nakayama et al, 2015. The number of adult offspring produced by the F2 generation of infected parental females was counted. Each F2 female was placed with two uninfected males in a vial of fly medium to mate. They were moved into fresh vials every day for five days to allow continuous oviposition. On the sixth day, adult flies were removed, and the females were screened for Spiroplasma. The eclosed offspring from days 2 to 5 were counted. <br><br><b>Column headings</b>:<br><b>Column A-</b> Block: Spiroplasma infection status of D. melanogaster. Spiroplasma positive (S+) and Spiroplasma negative (S-).<br><b>Column B</b>- Group: Independent D. melanogaster lines (B, F, G and H) derived from successfully transinfected females and an uninfected control (C). <br><b>Column C</b>- Rep: replicate female D. melanogaster<br><b>Column D</b>- D2M: number of emerged adult males from the second day of the fecundity assay<br><b>Column E</b>- D2F: number of emerged adult females from the second day of the fecundity assay<br><b>Column F</b>- D2T: total number of males and females from the second day of the fecundity assay<br><b>Column G</b>- D3M: number of emerged adult males from the third day of the fecundity assay<br><b>Column H</b>- D3F: number of emerged adult females from the third day of the fecundity assay<br><b>Column I</b>- D3T: total number of males and females from the third day of the fecundity assay <br><b>Column J</b>- D4M: number of emerged adult males from the fourth day of the fecundity assay<br><b>Column K</b>- D4F: number of emerged adult females from the fourth day of the fecundity assay <br><b>Column L</b>- D4T: total number of males and females from the fourth day of the fecundity assay<br><b>Column M</b>- D5M: number of emerged adult males from the fifth day of the fecundity assay<br><b>Column N</b>- D5F: number of emerged adult females from the fifth day of the fecundity assay <br><b>Column O</b>- D5T: total number of males and females from the fifth day of the fecundity assay <br><b>Column P</b>- Total: total number of adult flies produced from each female Spiroplasma-infected and -uninfected D. melanogaster.<br><br>
DOI: 10.6084/m9.figshare.13686172
title: Raw data of the protection assay conducted on Spiroplasma-transinfected Drosophila melanogaster CS, with Leptopolina heterotoma.

description: <b>Description of data:</b> The dataset contains a record of the number of adult flies and wasps that emerged following parasitoid wasp attack. D. melanogaster naturally infected with Spiroplasma MSRO were used as a positive control. Data is in xlsl format.<br><br><b>Description of methods for data collection:</b> F2 generation D. melanogaster larvae were exposed to L. heterotoma wasps, following artificial infection with Spiroplasma, Hy1. Six treatments were established: transinfected larvae with and without wasps (S+ Lh+, S+ Lh-), uninfected controls with and without wasps (S- Lh+, S- Lh-) and a positive control naturally infected D. melanogaster with and without wasps (MSRO Lh+, MSRO Lh-). For each treatment 10 replicate vials were established, each containing 20 first and second instar Drosophila larvae. The wasps were permitted to attack larvae for 3 days at 25°C under a 12 h:12 h light:dark cycle. The number of fly pupae, eclosed adult flies and the number of eclosed wasps were counted for each vial.<br><br><b>Column headings</b>:<br><b>Column A-</b> wasp_presence: presence (Lh+) or absence of (Lh-) of L. heterotoma wasps<br><b>Column B-</b> strain: strain of D. melanogaster used. D. mel is the Canton S strain in which Spiroplasma was artificially injected into. MSRO is the D. melanogaster strain naturally infected with Spiroplasma and was used as a control.<br><b>Column C-</b> rep: replicate line of transinfected flies.<br><b>Column D-</b> infection_status: Spiroplasma infection status of the Drosophila larvae. Infection derived from artificial transinfecton (S+), Uninfected control (S-) and Drosophila naturally infected with Spiroplasma MSRO strain (MSRO).<br><b>Column E-</b> larvae: number of larvae placed onto the surface of Drosophila food.<br><b>Column F-</b> pupae: number of pupae that developed in each vial<br><b>Column G-</b> fly: number of adult flies that emerged from fly pupae<br><b>Column H-</b> no_fly: number of adult flies that did not emerge from fly pupae<br><b>Column I-</b> wasp: number of adult wasps that emerged from fly pupae<br><b>Column J-</b> no_wasp: number of adult wasps that did not emerge from fly pupae<br><b>Column K-</b> wasp_survival: proportion of adult wasps that emerged from fly pupae<br><b>Column L-</b> fly_survival: proportion of adult flies that emerged from fly pupae<br><br>
DOI: 10.17188/1738957
title: Materials Data on Ca3SbP by Materials Project

description: Ca3SbP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Ca3Sb framework. In the Ca3Sb framework, Ca2+ is bonded in a linear geometry to two equivalent Sb3- atoms. Both Ca–Sb bond lengths are 2.87 Å. Sb3- is bonded to six equivalent Ca2+ atoms to form corner-sharing SbCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.6084/m9.figshare.13686181
title: Raw data of protection assay conducted on Drosophila simulans with Leptopolina heterotoma. Drosophila melanogaster naturally infected with Spiroplasma MSRO were used as a control.

description: <b>Description of data</b>: The dataset contains a record of the number of adult flies and wasps that emerged following parasitoid wasp attack. D. melanogaster naturally infected with Spiroplasma MSRO were used as a positive control. Data is in xlsl format.<br><br><b>Description of methods for data collection</b>: F2 generation D. melanogaster larvae were exposed to L. heterotoma wasps, following artificial infection with Spiroplasma, Hy1. Six treatments were established: transinfected larvae with and without wasps (S+ Lh+, S+ Lh-), uninfected controls with and without wasps (S- Lh+, S- Lh-) and a positive control naturally infected D. melanogaster with and without wasps (MSRO Lh+, MSRO Lh-). For each treatment 10 replicate vials were established, each containing 15 first and second instar Drosophila larvae. The wasps were permitted to attack larvae for 3 days at 25°C under a 12 h:12 h light:dark cycle. The number of fly pupae, eclosed adult flies and the number of eclosed wasps were counted for each vial.<br><br><b>Column headings</b>:<br><b>Column A-</b> wasp: presence (Lh+) or absence of (Lh-) of L. heterotoma wasps.<br><b>Column B-</b> species: species of Drosophila. D. simulans was artificially infected with Spiroplasma Hy1. D. melanogaster naturally infected with Spiroplasma MSRO was used as a control.<br><b>Column C-</b> line: replicate line of transinfected flies. <br><b>Column D-</b> infection_status: presence or absence of Spiroplasma in Drosophila larvae. Infection derived from artificial transinfecton (S+), uninfected control (S-) and Drosophila naturally infected with Spiroplasma MSRO strain (MSRO).<br><b>Column E-</b> larvae: number of larvae placed onto the surface of Drosophila food.<br><b>Column F- </b>pupae: number of pupae that developed in each vial<br><b>Column G-</b> fly: number of adult flies that emerged from fly pupae<br><b>Column H-</b> no_fly: number of adult flies that did not emerge from fly pupae<br><b>Column I- </b>wasp: number of adult wasps that emerged from fly pupae<br><b>Column J-</b> no_wasp: number of adult wasps that did not emerge from fly pupae<br><b>Column K-</b> wasp_survival: proportion of adult wasps that emerged from fly pupae<br><b>Column L-</b> fly_survival: proportion of adult flies that emerged from fly pupae
DOI: 10.6084/m9.figshare.13686175
title: The number of offspring produced by female Drosophila yakuba over 4 days following artificial transinfection of Spiroplasma, compared to uninfected controls.

description: <b>Description of data</b>: The dataset is a record of the number of adult offspring produced by F2 Spiroplasma-transinfected and -uninfected females. For each day there is a record of the number of males and females that emerged, followed by the total number of flies emerged. The D. yakuba strain used not infected with Wolbachia. Data is in xlsl format.<br><br><b>Description of methods for data collection</b>: Microinjections were carried out as described by Nakayama et al, 2015. The number of adult offspring produced by the F2 generation of infected parental females was counted. Each F2 female was placed with two uninfected males in a vial of fly medium to mate. They were moved into fresh vials every day for five days to allow continuous oviposition. On the sixth day, adult flies were removed, and the females were screened for Spiroplasma. The eclosed offspring from days 2 to 5 were counted. <br><br><b>Column headings</b>:<br><b>Column A-</b> Block: D. yakuba has been split into two groups depending on Spiroplasma infection status- Uninfected (A) and Infected (B).<br><b>Column B-</b> Group: Independent D. yakuba lines derived from successfully transinfected females (b, c, d, e, f and g) and an uninfected control (a) with alternative nomenclature for easy ordering in R.<br><b>Column C</b>- Infection.status: Spiroplasma infection status of D. yakuba. Spiroplasma positive (S+) and Spiroplasma negative controls (S-).<br><b>Column D-</b> Genotype: lineage of F2 mothers<br><b>Column E-</b> Rep: replicate female F2 D. yakuba<br><b>Column F- </b>D2M: number of emerged adult males from the second day of the fecundity assay<br><b>Column G-</b> D2F: number of emerged adult females from the second day of the fecundity assay<br><b>Column H-</b> D2T: total number of males and females from the second day of the fecundity assay<br><b>Column I-</b> D3M: number of emerged adult males from the third day of the fecundity assay<br><b>Column J-</b> D3F: number of emerged adult females from the third day of the fecundity assay<br><b>Column K-</b> D3T: total number of males and females from the third day of the fecundity assay <br><b>Column L-</b> D4M: number of emerged adult males from the fourth day of the fecundity assay<br><b>Column M-</b> D4F: number of emerged adult females from the fourth day of the fecundity assay <br><b>Column N-</b> D4T: total number of males and females from the fourth day of the fecundity assay<br><b>Column O-</b> D5M: number of emerged adult males from the fifth day of the fecundity assay<br><b>Column P-</b> D5F: number of emerged adult females from the fifth day of the fecundity assay<br><b>Column Q-</b> D5T: total number of males and females from the fifth day of the fecundity assay<br><b>Column R-</b> Total: total number of adult flies produced from each female Spiroplasma-infected and -uninfected D. yakuba.<br><br>