cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.25505/fiz.icsd.cc229kqp
title: CSD 1915822: Experimental Crystal Structure Determination

description: Related Article: Stefan Strangmüller,  Henrik Eickhoff,  David Müller,  Wilhelm Klein,  Gabriele Raudaschl-Sieber,  Holger Kirchhain,  Christian Sedlmeier,  Volodymyr Baran,  Anatoliy Senyshyn,  Volker L. Deringer,  Leo van Wüllen,  Hubert A. Gasteiger,  Thomas F. Fässler|2019|J.Am.Chem.Soc.|141|14200|doi:10.1021/jacs.9b05301
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc229ksr
title: CSD 1915824: Experimental Crystal Structure Determination

description: Related Article: Stefan Strangmüller,  Henrik Eickhoff,  David Müller,  Wilhelm Klein,  Gabriele Raudaschl-Sieber,  Holger Kirchhain,  Christian Sedlmeier,  Volodymyr Baran,  Anatoliy Senyshyn,  Volker L. Deringer,  Leo van Wüllen,  Hubert A. Gasteiger,  Thomas F. Fässler|2019|J.Am.Chem.Soc.|141|14200|doi:10.1021/jacs.9b05301
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc21ykl5
title: CSD 1905247: Experimental Crystal Structure Determination

description: Related Article: Yingjie Zhang, Robert D. Aughterson, Zhaoming Zhang, Tao Wei, Kimbal Lu, Jiří Čejka, Inna Karatchevtseva|2019|Inorg.Chem.|58|10812|doi:10.1021/acs.inorgchem.9b01102
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc21ykm6
title: CSD 1905248: Experimental Crystal Structure Determination

description: Related Article: Yingjie Zhang, Robert D. Aughterson, Zhaoming Zhang, Tao Wei, Kimbal Lu, Jiří Čejka, Inna Karatchevtseva|2019|Inorg.Chem.|58|10812|doi:10.1021/acs.inorgchem.9b01102
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22dvmz
title: CSD 1918981: Experimental Crystal Structure Determination

description: Related Article: Kristina Spektor, Wilson A. Crichton, Stanislav Filippov, Sergei I. Simak, Ulrich Häussermann|2019|Inorg.Chem.|58|11043|doi:10.1021/acs.inorgchem.9b01569
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22fwyc
title: CSD 1919983: Experimental Crystal Structure Determination

description: Related Article: Ya-Ping Gong, Yun-Xiang Ma, Shao-Ming Ying, Jiang-Gao Mao, Fang Kong|2019|Inorg.Chem.|58|11155|doi:10.1021/acs.inorgchem.9b01730
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22fwzd
title: CSD 1919984: Experimental Crystal Structure Determination

description: Related Article: Ya-Ping Gong, Yun-Xiang Ma, Shao-Ming Ying, Jiang-Gao Mao, Fang Kong|2019|Inorg.Chem.|58|11155|doi:10.1021/acs.inorgchem.9b01730
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22fydw
title: CSD 1920028: Experimental Crystal Structure Determination

description: Related Article: Nour El Houda Lamsakhar, Mohammed Hadouchi, Mohammed Zriouil, Abderrazzak Assani, Mohamed Saadi, Abdelilah Lahmar, Mimoun El Marssi, Lahcen El Ammari|2019|Inorg.Chem.Commun.|107|107472|doi:10.1016/j.inoche.2019.107472
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5281/zenodo.6812245
title: Database of the integrated model, used for the material and climate implication of car transition in China

description: Database of the integrated model, used for the material and climate implication of China car transition. All excel files are the parameter settings used in that case. All csv files are results under all scenarios.
DOI: 10.5281/zenodo.6812244
title: Database of the integrated model, used for the material and climate implication of car transition in China

description: Database of the integrated model, used for the material and climate implication of China car transition. All excel files are the parameter settings used in that case. All csv files are results under all scenarios.
DOI: 10.6084/m9.figshare.20277705
title: compiled_climate_response_data_CCME

description: This project contains a dataset compiled based on previous-published data from controlled experiments on responses of 14 species to marine climate change variables. We searched the published literature for controlled experiments in which (i) temperature, oxygen, pCO2, and/or salinity were varied within the range of mean values expected between the present and year 2100 in the California Current Marine Ecosystem and (ii) the individual-level response of these species was measured in one or more of the following categories: survival, metabolic rate, locomotion, somatic growth rate, and resource consumption rate. We extracted either (i) all individual-level observations of the response variable (including control treatments), or (ii) the mean, error estimate, and sample size of aggregated response data. When values were not reported as numbers, we estimated values from figures using WebPlotDigitizer (Rohatgi, 2018). In addition to the category of response, we noted the location of organism collection, experimental treatments, duration of exposure, life phase, and other environmental variables for each experiment. We included published studies through December of 2020. <br> These data are further described and used in Sunday <em>et al</em>. Biological sensitivities to high-resolution climate change projections in the California Current Marine Ecosystem. Global Change Biology. 2022. 10.1111/gcb.16317 <br> <br> link to live GitHub page: https://github.com/jennsunday/downscaled_sensitivities_CCME link to archived scripts: 10.6084/m9.figshare.16636087
DOI: 10.6084/m9.figshare.19775647
title: Supplemental Document (Revised&Highlighted).docx

description: Supplemental document.
DOI: 10.6084/m9.figshare.19775647.v1
title: Supplemental Document (Revised&Highlighted).docx

description: Supplemental document.
DOI: 10.6084/m9.figshare.19768174.v7
title: Chemical Multiverse: An Expanded View of Chemical Space

description: Technological advances and practical applications of the chemical space concept in drug discovery, natural product research, and several other research areas are continuously attracting the scientific community´s attention. The current large- and ultra-large chemical spaces are associated not only with the significant increase in the number of compounds that can potentially be made and exist, but also in the increasing number of experimental and calculated descriptors that are emerging that encode the molecular structure and/or property aspects of the molecules. Due to the importance and continued evolution of compound libraries, herein we review definitions proposed in the literature for chemical space and we emphasize the approaches to generate a consensus view of the chemical space. We also introduce the concept of<em> chemical multiverse</em> as an alternative view of the chemical space.
DOI: 10.25505/fiz.icsd.cc22zqwp
title: CSD 1936163: Experimental Crystal Structure Determination

description: Related Article: Patrick Pues, Sebastian Schwung, Daniel Rytz, Lea Schubert, Steffen Klenner, Frank Stegemann, Rainer Pöttgen, Thomas Jüstel|2019|J.Lumin.|215|116653|doi:10.1016/j.jlumin.2019.116653
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc22yhh1
title: CSD 1934973: Experimental Crystal Structure Determination

description: Related Article: Katherine E. Woo,  Jian Wang,  Justin Mark,  Kirill Kovnir|2019|J.Am.Chem.Soc.|141|13017|doi:10.1021/jacs.9b06803
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22zlm9
title: CSD 1936031: Experimental Crystal Structure Determination

description: Related Article: Patrick Pues, Sebastian Schwung, Daniel Rytz, Lea Schubert, Steffen Klenner, Frank Stegemann, Rainer Pöttgen, Thomas Jüstel|2019|J.Lumin.|215|116653|doi:10.1016/j.jlumin.2019.116653
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22zlnb
title: CSD 1936032: Experimental Crystal Structure Determination

description: Related Article: Patrick Pues, Sebastian Schwung, Daniel Rytz, Lea Schubert, Steffen Klenner, Frank Stegemann, Rainer Pöttgen, Thomas Jüstel|2019|J.Lumin.|215|116653|doi:10.1016/j.jlumin.2019.116653
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22ztkg
title: CSD 1936246: Experimental Crystal Structure Determination

description: Related Article: Meng Wang, Dequan Wei, Lanju Liang, Xin Yan, Kaikai Lv|2019|Inorg.Chem.Commun.|107|107486|doi:10.1016/j.inoche.2019.107486
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc22ztlh
title: CSD 1936247: Experimental Crystal Structure Determination

description: Related Article: Meng Wang, Dequan Wei, Lanju Liang, Xin Yan, Kaikai Lv|2019|Inorg.Chem.Commun.|107|107486|doi:10.1016/j.inoche.2019.107486
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc230hqc
title: CSD 1936902: Experimental Crystal Structure Determination

description: Related Article: Yuanyu Yang, Yao Guo, Yi-Gang Chen, Xiaofang Ma, Xian-Ming Zhang|2021|J.Solid State Chem.|293|121777|doi:10.1016/j.jssc.2020.121777
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc233nqm
title: CSD 1939940: Experimental Crystal Structure Determination

description: Related Article: Benjamin Scheibe, Michael Patzschke, Juliane März, Matthias Conrad, Florian Kraus|2020|Eur.J.Inorg.Chem.|2020|3753|doi:10.1002/ejic.202000565
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc2344s6
title: CCDC 1940407: Experimental Crystal Structure Determination

description: Related Article: Xiujun Yu,  Bingzhe Wang,  Younghoon Kim,  Jiyong Park,  Samrat Ghosh,  Barun Dhara,  Rahul Dev Mukhopadhyay,  Jaehyoung Koo,  Ikjin Kim,  Seungha Kim,  In-Chul Hwang,  Shu Seki,  Dirk M. Guldi,  Mu-Hyun Baik,  Kimoon Kim|2020|J.Am.Chem.Soc.|142|12596|doi:10.1021/jacs.0c05339
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: 10.25505/fiz.icsd.cc234fzp
title: CSD 1940692: Experimental Crystal Structure Determination

description: Related Article: Darren Carone, Vladislav V. Klepov, Mark D. Smith, Hans-Conrad zur Loye|2019|Inorg.Chem.|58|16831|doi:10.1021/acs.inorgchem.9b03015
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc234g0r
title: CSD 1940693: Experimental Crystal Structure Determination

description: Related Article: Darren Carone, Vladislav V. Klepov, Mark D. Smith, Hans-Conrad zur Loye|2019|Inorg.Chem.|58|16831|doi:10.1021/acs.inorgchem.9b03015
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc234g1s
title: CSD 1940694: Experimental Crystal Structure Determination

description: Related Article: Darren Carone, Vladislav V. Klepov, Mark D. Smith, Hans-Conrad zur Loye|2019|Inorg.Chem.|58|16831|doi:10.1021/acs.inorgchem.9b03015
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc234nhf
title: CCDC 1940894: Experimental Crystal Structure Determination

description: Related Article: Jun He, Yuhang Xue, Bo Han, Chunzhu Zhang, You Wang, Shaolin Zhu|2020|Angew.Chem.,Int.Ed.|59|2328|doi:10.1002/anie.201913743
description: Related Article: Xiaoxi Zhao, Ge Li, Jingjing Ma, Weisheng Liu|2020|Inorg.Chem.|59|2328|doi:10.1021/acs.inorgchem.9b03137
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.cc234njg
title: CCDC 1940895: Experimental Crystal Structure Determination

description: Related Article: Jun He, Yuhang Xue, Bo Han, Chunzhu Zhang, You Wang, Shaolin Zhu|2020|Angew.Chem.,Int.Ed.|59|2328|doi:10.1002/anie.201913743
description: Related Article: Xiaoxi Zhao, Ge Li, Jingjing Ma, Weisheng Liu|2020|Inorg.Chem.|59|2328|doi:10.1021/acs.inorgchem.9b03137
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.cc2344t7
title: CCDC 1940408: Experimental Crystal Structure Determination

description: Related Article: In-Chul Hwang|2020|CSD Communication|||
description: Related Article: Xiujun Yu,  Bingzhe Wang,  Younghoon Kim,  Jiyong Park,  Samrat Ghosh,  Barun Dhara,  Rahul Dev Mukhopadhyay,  Jaehyoung Koo,  Ikjin Kim,  Seungha Kim,  In-Chul Hwang,  Shu Seki,  Dirk M. Guldi,  Mu-Hyun Baik,  Kimoon Kim|2020|J.Am.Chem.Soc.|142|12596|doi:10.1021/jacs.0c05339
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: 10.25505/fiz.icsd.cc234qpp
title: CSD 1940962: Experimental Crystal Structure Determination

description: Related Article: Shengzi Zhang, Fei Liang, Pifu Gong, Yi Yang, Zheshuai Lin|2020|Inorg.Chem.|59|16132|doi:10.1021/acs.inorgchem.0c02952
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc2377by
title: CSD 1943369: Experimental Crystal Structure Determination

description: Related Article: Daniel S. Parsons, Savvaki N. Savva, Wai Chi Tang, Andrew Ingram, Joseph A. Hriljac|2019|Inorg.Chem.|58|16313|doi:10.1021/acs.inorgchem.9b02615
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.25505/fiz.icsd.cc239fjd
title: CSD 1945483: Experimental Crystal Structure Determination

description: Related Article: Tori Forbes, Dmytro V. Kravchuk|2019|Angew.Chem.,Int.Ed.|58|18429|doi:10.1002/anie.201910287
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
DOI: 10.5517/ccdc.csd.cc23bc4z
title: CCDC 1946370: Experimental Crystal Structure Determination

description: Related Article: Xiujun Cao, Xiaolong Zhang, Mingdao Zhang, Jinsong Hu|2020|Inorg.Chim.Acta|511|119836|doi:10.1016/j.ica.2020.119836
description: Related Article: Xiujun Cao, Xiaolong Zhang, Mingdao Zhang, Jinsong Hu|2020|Inorg.Chim.Acta|511|119836|doi:10.1016/j.ica.2020.119836
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.cc234qss
title: CSD 1940965: Experimental Crystal Structure Determination

description: Related Article: Philipp Schneiderhan, Patrick Schmidt, Markus Ströbele, Carl P. Romao, Hans-Jürgen Meyer|2020|Cryst.Growth Des.|20|3780|doi:10.1021/acs.cgd.0c00053
description: An entry from the Inorganic Crystal Structure Database, the world’s repository for inorganic crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the joint CCDC and FIZ Karlsruhe Access Structures service and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.