cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc1jyngl
title: CCDC 1428680: Experimental Crystal Structure Determination

description: Related Article: Yang Yang,  Vance O. Kennedy,  James B. Updegraph,  Brian Samas,  Dainius Macikenas,  Brian Chaloux,  Jacob A. Miller,  Erika M. Van Goethem,  and Malcolm E. Kenney|2012|J.Phys.Chem.A|116|8718|doi:10.1021/jp3025182
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/ccwqmmt
title: CCDC 826107: Experimental Crystal Structure Determination

description: Related Article: Victor A. Galievsky,  Sergey I. Druzhinin,  Attila Demeter,  Sergey A. Kovalenko,  Tamara Senyushkina,  Peter Mayer,  and Klaas A. Zachariasse|2011|J.Phys.Chem.A|115|10823|doi:10.1021/jp2045614
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/cc1jynhm
title: CCDC 1428681: Experimental Crystal Structure Determination

description: Related Article: Yang Yang,  Vance O. Kennedy,  James B. Updegraph,  Brian Samas,  Dainius Macikenas,  Brian Chaloux,  Jacob A. Miller,  Erika M. Van Goethem,  and Malcolm E. Kenney|2012|J.Phys.Chem.A|116|8718|doi:10.1021/jp3025182
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: 10.35097/rr0ja48j7cqjud5b
title: Datasets to the bidirectional process prediction in the laser-induced-graphene production using blackbox deep learning

description: Machine-learning techniques are highly advantageous for automation of a manufacturing process, since they facilitate prediction of the process parameters and product properties. However, the need for process-specific prior knowledge, for elaboration of complex analytical models, and for collection of a comprehensive training dataset notably limits their integration into the real-world applications. We pioneered and studied usage of a streamlined non-analytical approach to predict and optimize process parameters, radically adapted to the conditions of resource and knowledge constraints. The approach was employed for laser-induced graphene, which is an emerging flexible-electronics fabrication technique. The fabrication settings were successfully predicted and controlled by a blackbox neural network from the desired properties of the device, despite a small amount of moderate-quality training data. To prove feasibility of the concept, we designed and manufactured a functional electronic circuit. The proposed procedure is applicable for a broad range of functional materials and fabrication methods.
description: The datasets encompas collected training, validation, and test data as well as related mesuared LIG properties. Five dataset include (A) 500 training lines, (B) 100 validation lines and (C) 13 validation rectangles, (D) 50 twofold-control lines, and (E) 10 printed lines used for the demonstrator-circuitry characterization. For each collected sample, laser-beam parameters, and corresponding product (LIG) properties are presented. "Set" indicates input data: grid-distributed in the dataset A, randomly generated in the datasets B-D, and a single calculated value in the dataset E. "Predicted" stands for the neural-network predicted output data. "Measured" represents the actual, physically and optically measured sample properties.
DOI: 10.5517/cc1jynjn
title: CCDC 1428682: Experimental Crystal Structure Determination

description: Related Article: Yoriko Sonoda,  Yukihiro Shimoi,  Midori Goto,  Norimitsu Tohnai,  and Masatoshi Kanesato|2013|J.Phys.Chem.A|117|566|doi:10.1021/jp306103a
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/cc1jz2m6
title: CCDC 1429088: Experimental Crystal Structure Determination

description: Related Article: Randy W. Larsen and Lukasz Wojtas|2012|J.Phys.Chem.A|116|7830|doi:10.1021/jp302979a
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: 10.5281/zenodo.17381548
title: Dataset of "Comprehensive understanding of CO gas sensing by combining transient and steady-state spectroscopies: A mechanistic study on SnO2 and gold-loaded SnO2"

description: This zip file contains the dataset of the publication "Comprehensive understanding of CO gas sensing by combining transient and steady-state spectroscopies: A mechanistic study on SnO2 and gold-loaded SnO2". The authors are Maximilian Pfeiffer, Johannes Pfeiffer and Christan Hess*. The zip file includes the data for figures 1-8 in the manuscript and the data for figures S2-S30 in the SI. For more detailed information on the dataset, please refer to the description file. 

*email: christian.hess@tu-darmstadt.de
description: This work was supported by the Deutsche Forschungsgemeinschaft (HE 4515/6-3).
DOI: 10.5517/cc1jynkp
title: CCDC 1428683: Experimental Crystal Structure Determination

description: Related Article: Yoriko Sonoda,  Yukihiro Shimoi,  Midori Goto,  Norimitsu Tohnai,  and Masatoshi Kanesato|2013|J.Phys.Chem.A|117|566|doi:10.1021/jp306103a
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/ccycmxt
title: CCDC 875127: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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: 10.5281/zenodo.15923288
title: Dataset of "Comprehensive understanding of CO gas sensing by combining transient and steady-state spectroscopies: A mechanistic study on SnO2 and gold-loaded SnO2"

description: This zip file contains the dataset of the publication "Comprehensive understanding of CO gas sensing by combining transient and steady-state spectroscopies: A mechanistic study on SnO2 and gold-loaded SnO2". The authors are Maximilian Pfeiffer, Johannes Pfeiffer and Christan Hess*. The zip file includes the data for figures 1-8 in the manuscript and the data for figures S2-S30 in the SI. For more detailed information on the dataset, please refer to the description file. 

*email: christian.hess@tu-darmstadt.de
description: This work was supported by the Deutsche Forschungsgemeinschaft (HE 4515/6-3).
DOI: 10.5517/ccycmws
title: CCDC 875126: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycnc9
title: CCDC 875141: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycn75
title: CCDC 875137: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycnb8
title: CCDC 875140: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycmtq
title: CCDC 875124: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycmyv
title: CCDC 875128: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/ccycn31
title: CCDC 875133: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/cc1jynlq
title: CCDC 1428684: Experimental Crystal Structure Determination

description: Related Article: M. Amine Fourati,  W. G. Skene,  C. Géraldine Bazuin,  and Robert E. Prud’homme|2013|J.Phys.Chem.A|117|836|doi:10.1021/jp312598c
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/ccycn97
title: CCDC 875139: Experimental Crystal Structure Determination

description: Related Article: Daniel M. Seo,  Taliman Afroz,  Joshua L. Allen,  Paul D. Boyle,  Paul C. Trulove,  Hugh C. De Long,   Wesley A. Henderson|2014|J.Phys.Chem.C|118|25884|doi:10.1021/jp5079168
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/cc1jynmr
title: CCDC 1428685: Experimental Crystal Structure Determination

description: Related Article: Michael J. Colaneri,  Jacqueline Vitali,  and Kristin Kirschbaum|2013|J.Phys.Chem.A|117|3414|doi:10.1021/jp401477m
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: 10.5281/zenodo.17425937
title: Data archive for: Nematomorph parasites potentially drive nutritional flow from terrestrial to aquatic ecosystems
DOI: 10.5517/cc1jynns
title: CCDC 1428686: Experimental Crystal Structure Determination

description: Related Article: Michael J. Colaneri,  Jacqueline Vitali,  and Kristin Kirschbaum|2013|J.Phys.Chem.A|117|3414|doi:10.1021/jp401477m
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/cc1jynpt
title: CCDC 1428687: Experimental Crystal Structure Determination

description: Related Article: Ling Zhu, Kang Zheng, Yan-Tuan Li, Zhi-Yong Wu, Cui-Wei Yan|2016|J.Photochem.Photobiol.,B|155|86|doi:10.1016/j.jphotobiol.2015.12.015
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/cc1jynqv
title: CCDC 1428688: Experimental Crystal Structure Determination

description: Related Article: Paul J. Vallett and Niels H. Damrauer|2013|J.Phys.Chem.A|117|6489|doi:10.1021/jp404248z
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/cc11lsdt
title: CCDC 971366: Experimental Crystal Structure Determination

description: Related Article: Tetsuo Yamaguchi,  Sayaka Hatano,  and Jiro Abe|2014|J.Phys.Chem.A|118|134|doi:10.1021/jp411190d
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/cc11lsfv
title: CCDC 971367: Experimental Crystal Structure Determination

description: Related Article: Tetsuo Yamaguchi,  Sayaka Hatano,  and Jiro Abe|2014|J.Phys.Chem.A|118|134|doi:10.1021/jp411190d
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/cc11lsgw
title: CCDC 971368: Experimental Crystal Structure Determination

description: Related Article: Tetsuo Yamaguchi,  Sayaka Hatano,  and Jiro Abe|2014|J.Phys.Chem.A|118|134|doi:10.1021/jp411190d
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/cc11lshx
title: CCDC 971369: Experimental Crystal Structure Determination

description: Related Article: Tetsuo Yamaguchi,  Sayaka Hatano,  and Jiro Abe|2014|J.Phys.Chem.A|118|134|doi:10.1021/jp411190d
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/cc1jynrw
title: CCDC 1428689: Experimental Crystal Structure Determination

description: Related Article: Piotr Garbacz,  Victor V. Terskikh,  Michael J. Ferguson,  Guy M. Bernard,  Mariusz Kędziorek,  and Roderick E. Wasylishen|2014|J.Phys.Chem.A|118|1203|doi:10.1021/jp411378j
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: 10.15468/dl.6ndrzz
title: Occurrence Download

description: A dataset containing 985 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Populus berolinensis",
 "HasCoordinate is true"
 ]
}

 The dataset includes 985 records from 61 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0052604-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc1jynsx
title: CCDC 1428690: Experimental Crystal Structure Determination

description: Related Article: Piotr Garbacz,  Victor V. Terskikh,  Michael J. Ferguson,  Guy M. Bernard,  Mariusz Kędziorek,  and Roderick E. Wasylishen|2014|J.Phys.Chem.A|118|1203|doi:10.1021/jp411378j
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/cc1jynty
title: CCDC 1428691: Experimental Crystal Structure Determination

description: Related Article: Takashi Hirose,  Yuki Inoue,  Jun-ya Hasegawa,  Kenji Higashiguchi,  and Kenji Matsuda|2014|J.Phys.Chem.A|118|1084|doi:10.1021/jp4122694
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/cc10c4p6
title: CCDC 934237: Experimental Crystal Structure Determination

description: Related Article: Atsuya Muranaka,  Shino Ohira,  Naoyuki Toriumi,  Machiko Hirayama,  Fumiko Kyotani,  Yukie Mori,  Daisuke Hashizume,  and Masanobu Uchiyama|2014|J.Phys.Chem.A|118|4415|doi:10.1021/jp5001557
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/cc10c4q7
title: CCDC 934238: Experimental Crystal Structure Determination

description: Related Article: Atsuya Muranaka,  Shino Ohira,  Naoyuki Toriumi,  Machiko Hirayama,  Fumiko Kyotani,  Yukie Mori,  Daisuke Hashizume,  and Masanobu Uchiyama|2014|J.Phys.Chem.A|118|4415|doi:10.1021/jp5001557
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/cc10c4r8
title: CCDC 934239: Experimental Crystal Structure Determination

description: Related Article: Atsuya Muranaka,  Shino Ohira,  Naoyuki Toriumi,  Machiko Hirayama,  Fumiko Kyotani,  Yukie Mori,  Daisuke Hashizume,  and Masanobu Uchiyama|2014|J.Phys.Chem.A|118|4415|doi:10.1021/jp5001557
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.