cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc222sfd
title: CCDC 1909303: Experimental Crystal Structure Determination

description: Related Article: Kevin Schwitalla, Wing Lee, Malte Fischer, Marc Schmidtmann, Rüdiger Beckhaus|2023|Organometallics|42|1259|doi:10.1021/acs.organomet.2c00588
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc222sgf
title: CCDC 1909304: Experimental Crystal Structure Determination

description: Related Article: Kevin Schwitalla, Wing Lee, Malte Fischer, Marc Schmidtmann, Rüdiger Beckhaus|2023|Organometallics|42|1259|doi:10.1021/acs.organomet.2c00588
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2djjfx
title: CCDC 2220419: Experimental Crystal Structure Determination

description: Related Article: Kevin Schwitalla, Wing Lee, Malte Fischer, Marc Schmidtmann, Rüdiger Beckhaus|2023|Organometallics|42|1259|doi:10.1021/acs.organomet.2c00588
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2djjgy
title: CCDC 2220420: Experimental Crystal Structure Determination

description: Related Article: Kevin Schwitalla, Wing Lee, Malte Fischer, Marc Schmidtmann, Rüdiger Beckhaus|2023|Organometallics|42|1259|doi:10.1021/acs.organomet.2c00588
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2djjhz
title: CCDC 2220421: Experimental Crystal Structure Determination

description: Related Article: Kevin Schwitalla, Wing Lee, Malte Fischer, Marc Schmidtmann, Rüdiger Beckhaus|2023|Organometallics|42|1259|doi:10.1021/acs.organomet.2c00588
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy81p
title: CCDC 2232652: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy83r
title: CCDC 2232654: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy82q
title: CCDC 2232653: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy84s
title: CCDC 2232655: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy85t
title: CCDC 2232656: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy86v
title: CCDC 2232657: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy87w
title: CCDC 2232658: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy88x
title: CCDC 2232659: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy89y
title: CCDC 2232660: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2dy8bz
title: CCDC 2232661: Experimental Crystal Structure Determination

description: Related Article: Alexey N. Bilyachenko, Victor N. Khrustalev, Grigorii S. Astakhov, Anna Y. Zueva, Ivan S. Arteev, Yan V. Zubavichus, Alexander A. Korlyukov, Pavel V. Dorovatovskii, Lidia S. Shul’pina, Nikolay S. Ikonnikov, Marina V. Kirillova, Elena S. Shubina, Yuriy N. Kozlov, Alexander M. Kirillov, Georgiy B. Shul’pin|2023|Organometallics|42|2577|doi:10.1021/acs.organomet.2c00649
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fd8gl
title: CCDC 2246119: Experimental Crystal Structure Determination

description: Related Article: Lucas Bacheley, Ricardo Molina Betancourt, Rathies Ravindra, Gérard Guillamot, Phannarath Phansavath, Virginie Ratovelomanana-Vidal|2023|Eur.J.Org.Chem.|26|e202300383|doi:10.1002/ejoc.202300383
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2ff9pw
title: CCDC 2247118: Experimental Crystal Structure Determination

description: Related Article: Marcos Escolano, Daniel Gaviña, Santiago Díaz-Oltra, María Sánchez-Roselló, Carlos del Pozo|2023|Org.Lett.|25|3222|doi:10.1021/acs.orglett.3c00903
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2ffcbl
title: CCDC 2247169: Experimental Crystal Structure Determination

description: Related Article: Marcos Escolano, Daniel Gaviña, Santiago Díaz-Oltra, María Sánchez-Roselló, Carlos del Pozo|2023|Org.Lett.|25|3222|doi:10.1021/acs.orglett.3c00903
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2flxpn
title: CCDC 2252512: Experimental Crystal Structure Determination

description: Related Article: Jan Jelen, Gašper Tavčar|2023|Org.Lett.|25|3649|doi:10.1021/acs.orglett.3c01018
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2flygg
title: CCDC 2252536: Experimental Crystal Structure Determination

description: Related Article: Jan Jelen, Gašper Tavčar|2023|Org.Lett.|25|3649|doi:10.1021/acs.orglett.3c01018
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2flyqq
title: CCDC 2252544: Experimental Crystal Structure Determination

description: Related Article: Jan Jelen, Gašper Tavčar|2023|Org.Lett.|25|3649|doi:10.1021/acs.orglett.3c01018
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fpvgg
title: CCDC 2255326: Experimental Crystal Structure Determination

description: Related Article: Miguel A. Esteruelas, Enrique Oñate, Sonia Paz|2023|Organometallics|42|1963|doi:10.1021/acs.organomet.3c00194
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fpvhh
title: CCDC 2255327: Experimental Crystal Structure Determination

description: Related Article: Miguel A. Esteruelas, Enrique Oñate, Sonia Paz|2023|Organometallics|42|1963|doi:10.1021/acs.organomet.3c00194
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fpvjj
title: CCDC 2255328: Experimental Crystal Structure Determination

description: Related Article: Miguel A. Esteruelas, Enrique Oñate, Sonia Paz|2023|Organometallics|42|1963|doi:10.1021/acs.organomet.3c00194
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fpvkk
title: CCDC 2255329: Experimental Crystal Structure Determination

description: Related Article: Miguel A. Esteruelas, Enrique Oñate, Sonia Paz|2023|Organometallics|42|1963|doi:10.1021/acs.organomet.3c00194
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2fpvll
title: CCDC 2255330: Experimental Crystal Structure Determination

description: Related Article: Miguel A. Esteruelas, Enrique Oñate, Sonia Paz|2023|Organometallics|42|1963|doi:10.1021/acs.organomet.3c00194
description: An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.6084/m9.figshare.25471438
title: NMR_IR_MALDI_analysis_IC2316932

description: A. Mrzygłód, M. Rzonsowska, M. P. García-Armada, B. Dudziec, M. Nowicki<br>Metallodendrimers Unveiled: Investigating the Formation and Unique Features of Double-Decker Silsesquioxane-Based Silylferrocene Dendrimers<br>Inorg. Chem. 2023, 62, 41, 16932–16942<br>metadata for NMR_IR_MALDI<br>sample denoted as 1426 - in publication it is G1-DDSQ-Fc8sample denoted as 1427 - in publication it is G2-DDSQ-Fc16
DOI: 10.6084/m9.figshare.25471438.v1
title: NMR_IR_MALDI_analysis_IC2316932

description: A. Mrzygłód, M. Rzonsowska, M. P. García-Armada, B. Dudziec, M. Nowicki<br>Metallodendrimers Unveiled: Investigating the Formation and Unique Features of Double-Decker Silsesquioxane-Based Silylferrocene Dendrimers<br>Inorg. Chem. 2023, 62, 41, 16932–16942<br>metadata for NMR_IR_MALDI<br>sample denoted as 1426 - in publication it is G1-DDSQ-Fc8sample denoted as 1427 - in publication it is G2-DDSQ-Fc16
DOI: 10.58032/agh/h5hhyw
title: Evaluation of phase stability and diffusion kinetics in novel BCC-structured high entropy alloys - research data

description: The diffusion kinetics of the BCC-structured high-entropy alloys (HEAs) is studied experimentally for the first time. First, the literature data regarding the transition-metal based, single-phase, BCCstructured HEAs is re-evaluated using the state-of-the-art, HEAs-dedicated TCHEA4 thermodynamic database, signalizing the need for further reassessment of the literature data accumulated during the last decade. The selected Al-Cr-Fe-Mn-V system was used for the interdiffusion experiments. The concentration profiles were evaluated using the numerical combinatorial approach, revealing surprisingly fast diffusion kinetics. The comparison with the available diffusion data for conventional BCC alloys supports recent findings regarding the lack of the ‘sluggish diffusion’ in HEAs.
DOI: 10.6084/m9.figshare.25470241
title: CV analysis_IC2316932

description: A. Mrzygłód, M. Rzonsowska, M. P. García-Armada, B. Dudziec, M. Nowicki<br>Metallodendrimers Unveiled: Investigating the Formation and Unique Features of Double-Decker Silsesquioxane-Based Silylferrocene Dendrimers<br>Inorg. Chem. 2023, 62, 41, 16932–16942<br>Metadata for CV analysis<br>sample denoted as 1426 - in publication it is G1-DDSQ-Fc8sample denoted as 1427 - in publication it is G2-DDSQ-Fc16
DOI: 10.6084/m9.figshare.25470241.v1
title: CV analysis

description: A. Mrzygłód, M. Rzonsowska, M. P. García-Armada, B. Dudziec, M. Nowicki<br>Metallodendrimers Unveiled: Investigating the Formation and Unique Features of Double-Decker Silsesquioxane-Based Silylferrocene Dendrimers<br>Inorg. Chem. 2023, 62, 41, 16932–16942<br>Metadata for CV analysis<br>sample denoted as 1426 - in publication it is G1-DDSQ-Fc8sample denoted as 1427 - in publication it is G2-DDSQ-Fc16
DOI: 10.5281/zenodo.10604551
title: Dataset for "Complexity of crack front geometry enhances toughness of brittle solids"

description: This data package supports the publication

'Complexity of crack front geometry enhances toughness of brittle solids'

by Xinyue Wei, Chenzhuo Li, Cían McCarthy, and John M. Kolinski

Nature physics (2024) - https://doi.org/10.1038/s41567-024-02435-x

 

DOI: 10.5281/zenodo.10604552

 

 

The data package includes 

- data for material characterization in 'material_test.xlsx';

- segmented 3D crack data in "segmented_3D_crack_stacks" folder.

 

 

'material_test.xlsx' includes

- shear modulus for Gel1, Gel2, Gel3, Gel4, and PDMS;

- stretch v.s. engineering stress for the five materials.

 

 

'segmented_3D_crack_stacks' includes

- 'sample_info.xlsx': metadata for all the cracks including the critically loaded cracks and the cracks with local 

  propagation in two sheets, with the following information:

- 'crack_name' corresponds to the title of each tif file in the subfolders;

- 'sample' indicates the material and thickness of the samples;

- 'xy_scale_um' and 'z_scale_um' are the resolutions in microns in xyz direction ;

- 's_start' and 's_end' provide the range of the valid slices, with s_end excluded. The first slice is s=0;

- 'tile_s_start' and 'tile_s_end' provide the range of the valid slices of the tile scans. The tile scans 

          are taken for the measurement of strain energy release rate from the far field CTOD. Since the field of 

  view is large enough to cover the K-dominant region of Gel1, tile scan is not taken for Gel1;

- 'remarks' are the comments for the data points (if applicable).

 

- 'critically_loaded_cracks': tif stacks for the binarized 3D cracks that are loaded to critical state. 

   Different materials and sample thicknesses are in separate folders. 

- 'local_propagation': tif stacks for the binarized 3D cracks before critically loaded.