cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc26mgr2
title: CCDC 2044504: Experimental Crystal Structure Determination

description: Related Article: Bao-Cheng Wang, Li Rao, Kai-Xin Fang, Bao-Le Qu, Fen-Ya Xiong, Ying Feng, Ying Tan, Liang-Qiu Lu, Wen-Jing Xiao|2023|Angew.Chem.,Int.Ed.|62||doi:10.1002/anie.202301592
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.cc1zc18n
title: CCDC 1827861: Experimental Crystal Structure Determination

description: Related Article: K.S. Neethu, S. Sivaselvam, M. Theetharappan, J. Ranjitha, N.S.P. Bhuvanesh, N. Ponpandian, M.A. Neelakantan, M.V. Kaveri|2021|Inorg.Chim.Acta|524|120419|doi:10.1016/j.ica.2021.120419
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.cc26mgs3
title: CCDC 2044505: Experimental Crystal Structure Determination

description: Related Article: Bao-Cheng Wang, Li Rao, Kai-Xin Fang, Bao-Le Qu, Fen-Ya Xiong, Ying Feng, Ying Tan, Liang-Qiu Lu, Wen-Jing Xiao|2023|Angew.Chem.,Int.Ed.|62||doi:10.1002/anie.202301592
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.cc26mhcq
title: CCDC 2044523: Experimental Crystal Structure Determination

description: Related Article: Xinzhang Lin, Keju Sun, Xuemei Fu, Xiuqing Ren, Yang Yang, Chao Liu, Jiahui Huang|2021|J.Phys.Chem.C|125|2194|doi:10.1021/acs.jpcc.0c10481
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.cc26mhdr
title: CCDC 2044524: Experimental Crystal Structure Determination

description: Related Article: Xinzhang Lin, Keju Sun, Xuemei Fu, Xiuqing Ren, Yang Yang, Chao Liu, Jiahui Huang|2021|J.Phys.Chem.C|125|2194|doi:10.1021/acs.jpcc.0c10481
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.cc26mhjw
title: CCDC 2044528: Experimental Crystal Structure Determination

description: Related Article: Xinzhang Lin, Keju Sun, Xuemei Fu, Xiuqing Ren, Yang Yang, Chao Liu, Jiahui Huang|2021|J.Phys.Chem.C|125|2194|doi:10.1021/acs.jpcc.0c10481
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.cc26mj2g
title: CCDC 2044545: Experimental Crystal Structure Determination

description: Related Article: Bo-Shuai Mu, Xiao-Yuan Cui, Xing-Ping Zeng, Jin-Sheng Yu, Jian Zhou|2021|Nat.Commun.|12|2219|doi:10.1038/s41467-021-22374-y
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.cc26mj4j
title: CCDC 2044547: Experimental Crystal Structure Determination

description: Related Article: Pengcheng Jiang, Lisi Zhan, Xiaosong Cao, Xialei Lv, Shaolong Gong, Changjiang Zhou, Zhongyan Huang, Fan Ni, Yang Zou, Chuluo Yang|2020|ChemRxiv|||doi:10.26434/chemrxiv.13285847.v1
description: Related Article: Pengcheng Jiang, Jingsheng Miao, Xiaosong Cao, Han Xia, Ke Pan, Tao Hua, Xialei Lv, Zhongyan Huang, Yang Zou, Chuluo Yang|2022|Adv.Mater.|34|2106954|doi:10.1002/adma.202106954
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.cc26mj6l
title: CCDC 2044549: Experimental Crystal Structure Determination

description: Related Article: Pengcheng Jiang, Lisi Zhan, Xiaosong Cao, Xialei Lv, Shaolong Gong, Changjiang Zhou, Zhongyan Huang, Fan Ni, Yang Zou, Chuluo Yang|2020|ChemRxiv|||doi:10.26434/chemrxiv.13285847.v1
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.cc26mjbq
title: CCDC 2044553: Experimental Crystal Structure Determination

description: Related Article: Zhengyi Di, Jiandong Pang, Falu Hu, Mingyan Wu, Maochun Hong|2021|Nano Res.|14|2584|doi:10.1007/s12274-020-3258-y
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.cc26mlk0
title: CCDC 2044622: Experimental Crystal Structure Determination

description: Related Article: Fabien L. Grasset, Richard Welter, Pierre Braunstein, Hélène Olivier‐Bourbigou, Lionel Magna|2021|ChemCatChem|13|2167|doi:10.1002/cctc.202002029
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.cc265j20
title: CCDC 2031091: Experimental Crystal Structure Determination

description: Related Article: Ze-Yu Du, Yan-Zhao Yu, Ya-Lin Hong, Ning-Fang Li, Ye-Min Han, Jia-Peng Cao, Qi Sun, Hua Mei, Yan Xu|2020|ACS Applied Materials and Interfaces|12|57174|doi:10.1021/acsami.0c18970
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.cc265j31
title: CCDC 2031092: Experimental Crystal Structure Determination

description: Related Article: Ze-Yu Du, Yan-Zhao Yu, Ya-Lin Hong, Ning-Fang Li, Ye-Min Han, Jia-Peng Cao, Qi Sun, Hua Mei, Yan Xu|2020|ACS Applied Materials and Interfaces|12|57174|doi:10.1021/acsami.0c18970
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.cc26mjw8
title: CCDC 2044570: Experimental Crystal Structure Determination

description: Related Article: Md Kamal Hossain, Jörg A. Schachner, Matti Haukka, Michael G. Richmond, Nadia C. Mösch-Zanetti, Ari Lehtonen, Ebbe Nordlander|2021|Polyhedron|205|115234|doi:10.1016/j.poly.2021.115234
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.cc26mjx9
title: CCDC 2044571: Experimental Crystal Structure Determination

description: Related Article: Md Kamal Hossain, Jörg A. Schachner, Matti Haukka, Michael G. Richmond, Nadia C. Mösch-Zanetti, Ari Lehtonen, Ebbe Nordlander|2021|Polyhedron|205|115234|doi:10.1016/j.poly.2021.115234
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.cc26mjyb
title: CCDC 2044572: Experimental Crystal Structure Determination

description: Related Article: Md Kamal Hossain, Jörg A. Schachner, Matti Haukka, Michael G. Richmond, Nadia C. Mösch-Zanetti, Ari Lehtonen, Ebbe Nordlander|2021|Polyhedron|205|115234|doi:10.1016/j.poly.2021.115234
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.cc26mjzc
title: CCDC 2044573: Experimental Crystal Structure Determination

description: Related Article: Md Kamal Hossain, Jörg A. Schachner, Matti Haukka, Michael G. Richmond, Nadia C. Mösch-Zanetti, Ari Lehtonen, Ebbe Nordlander|2021|Polyhedron|205|115234|doi:10.1016/j.poly.2021.115234
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.cc26mk2h
title: CCDC 2044576: Experimental Crystal Structure Determination

description: Related Article: Henryk Mastalarz, Agnieszka Mastalarz, Joanna Wietrzyk, Magdalena Milczarek, Andrzej Kochel, Andrzej Regiec|2020|Pharmaceuticals|13|433|doi:10.3390/ph13120433
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.cc26mkgw
title: CCDC 2044588: Experimental Crystal Structure Determination

description: Related Article: Elmira Khusnutdinova, Zarema Galimova, Alexander Lobov, Irina Baikova, Oxana Kazakova, Ha Nguyen Thi Thu, Nguyen Van Tuyen, Yuri Gatilov, René Csuk, Immo Serbian, Sophie Hoenke|2021|Nat.Prod.Res.|36|1|doi:10.1080/14786419.2021.1922904
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.cc26mm0h
title: CCDC 2044636: Experimental Crystal Structure Determination

description: Related Article: Soumyaranjan Pati, Renata G. Almeida, Eufrânio N. da Silva Júnior, Irishi N. N. Namboothiri|2021|Beilstein J.Org.Chem.|17|762|doi:10.3762/bjoc.17.66
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.cc26mkjy
title: CSD 2044590: Experimental Crystal Structure Determination

description: Related Article: Sebastian Bette,  Thomas Theye,  Heinz-Jürgen Bernhardt,  William P. Clark,  Rainer Niewa|2021|Minerals|11|290|doi:10.3390/min11030290
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.cc26mkhx
title: CCDC 2044589: Experimental Crystal Structure Determination

description: Related Article: M. P. Davydova, I. Yu. Bagryanskaya, A. V. Artem'ev|2020|CSD Communication|||
description: Related Article: M. P. Davydova, I. Yu. Bagryanskaya, E. H. Sadykov, A. V. Artem′ev|2022|J.Struct.Chem.|63|2020|doi:10.1134/S0022476622120137
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.cc26mkzd
title: CCDC 2044604: Experimental Crystal Structure Determination

description: Related Article: Xi Deng,  Jiandong Guo,  Xiaofeng Zhang,  Xiaotai Wang,  Weiping Su|2021|Angew.Chem.,Int.Ed.|60|24510|doi:10.1002/anie.202106356
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.cc26ml0g
title: CCDC 2044605: Experimental Crystal Structure Determination

description: Related Article: Xi Deng,  Jiandong Guo,  Xiaofeng Zhang,  Xiaotai Wang,  Weiping Su|2021|Angew.Chem.,Int.Ed.|60|24510|doi:10.1002/anie.202106356
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.cc25x0ch
title: CCDC 2022916: Experimental Crystal Structure Determination

description: Related Article: Ferdaousse Rhoufal, Salaheddine Guesmi, El Mostafa Ketatni, Laurent Jouffret, El Kebir Hlil, Nicolas Sergent, Saïd Obbade, Fouad Bentiss|2021|Polyhedron|195|114992|doi:10.1016/j.poly.2020.114992
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.cc26ml2j
title: CCDC 2044607: Experimental Crystal Structure Determination

description: Related Article: Xi Deng,  Jiandong Guo,  Xiaofeng Zhang,  Xiaotai Wang,  Weiping Su|2021|Angew.Chem.,Int.Ed.|60|24510|doi:10.1002/anie.202106356
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: 10.15151/esrf-es-2156214972
title: In situ characterization of 2D SiC growth on liquid copper by GIXRD

description: The use of liquid metal catalysts (LMCat) is a promising fabrication technique for the large scale, defect less and fast growth of graphene and related 2D materials. Specifically, the growth of 2D-SiC on LMCat substrates follows the methodology previously developed for our successful growth of Mo2C on liquid Cu. The successful growth of such 2D-SiC is not fully supported yet. Preliminary experiments in ID10 reactor revealed the growth of 3C SiC in liquid copper, in-situ monitored by grazing incidence X-ray diffraction (GIXD) and Radiation Mode Microscopy (RMM). The aim of our proposal is to take a step further and determine in detail the growth conditions of 2D-SiC on liquid copper, emphasizing to the crystallographic phase in order to favour the formation of the hexagonal 2H phase. This experimental strategy will enable us to understand further the exact growth mechanisms and fine tune the conditions with regards to temperature, time and especially hydrocarbon precursor flow.
DOI: 10.15151/esrf-es-2156216930
title: In situ X-ray diffraction study of the formation and texture of transient Sc and Y (germano)silicides for contact applications.

description: As a result of aggressive CMOS scaling, parasitic resistances play an increasingly important role in modern devices. Further improvements in device performance necessitate the use of new contact materials providing lower specific contact resistivities. The goal of this proposal is to investigate the silicidation of Sc and Y, deposited on highly doped epitaxial source/drain (S/D) layers, when subjected to post-metal annealing (PMA) treatments. The resulting (poly)crystallinity, and in particular, the texture of the metal (silicide) will be investigated by conducting in situ (i.e. temperature-resolved) X-ray diffraction (XRD) pole figure measurements.
DOI: 10.15151/esrf-es-2156223187
title: High-resolution reconstruction of the insect peripheral nervous system

description: Animals interact with the world by coordinating the movement of left-right pairs of limbs. Typically, each pair of limbs evolved different anatomy to perform complementary functions. The nervous system has likewise evolved distinct neural circuits to control limbs with different anatomy. How are limb anatomical specializations represented at the level of synaptic connections between neurons? The fruit fly, Drosophila melanogaster, is an emerging model for understanding the neural circuits that control locomotion. Here, we propose to image the external and internal anatomy of a fly’s middle and hind legs at ~100 nm resolution to complement our X-ray tomographic volume of a fly’s front leg (project LS-2845, Kuan et al. 2020, Nature Neuroscience, Azevedo et al. 2024, Nature). The resulting anatomical detail will allow us to relate quantitative comparisons of neural circuit connectivity to neuromechanical specializations of the legs.
DOI: 10.15151/esrf-es-2156224743
title: Influence of cyclic slip irreversibility at a penetrable grain boundary with pre-defined transmission path during cyclic loading

description: This proposal aims at investigating the 3D damage evolution during first stage fatigue near a penetrable grain boundary with pre-defined transmission path in micron-sized copper cantilevers. To do so, we will combine the recent 3D-microLaue technique of BM32 with the users’ in situ micro-deformation capabilities (MA-3607), to measure cyclically loaded Cu bi-crystals. The X-ray microscope will provide 3D microstructural quantities (local strains, dislocations densities, etc.) with high spatial resolution (&lt; 0.5 µm) relevant to understand the interaction mechanisms between dislocations and grain boundaries, which will help formulating mechanism-based material laws.
DOI: 10.15151/esrf-es-2156232825
title: The state of critical elements: valency and distribution of Ge in colloform sphalerite

description: Sphalerite (ZnS) is a significant host for critical elements (Ge, Ga, In, Co) and Ge elemental composition is used to determine the temperature of ore emplacement and the fractionation of Ge isotopes is related to temperature, redox conditions, and/or sphalerite crystal structure. Two types of sphalerite crystal fabrics are generally observed: euhedral and colloform. In euhedral coarse sphalerite crystals, Ge is generally incorporated in the sphalerite crystal lattice as tetravalent cation.
Colloform sphalerite is composed of a mix of acicular and euhedral crystals. Germanium is hosted in halogen-rich nanoscale fluid inclusions rather than in the crystal lattice. However, no investigation of Ge redox state has been performed in colloform sphalerite. This proposal aims to investigate the valency of Ge in colloform and euhedral sphalerite. Micro-XRF mapping and XANES-EXAFS of Ge will be performed on sphalerite to evaluate the influence of incorporation mechanisms on Ge redox state.
DOI: 10.15151/esrf-es-2156308348
title: 3D Probing of ferroelectric Domains via Bragg Coherent Modulation Imaging

description: The complexity of ferroelectric domains presents a substantial challenge for characterization, especially with a non-destructive 3D probe. While Bragg Coherent Diffraction Imaging (BCDI) holds promise for this task, it still has some limitations. We have demonstrated that the Bragg Coherent Modulation Imaging (BCMI) technique is better suited for characterizing complex systems. This proposal aims to leverage the unique strengths of BCMI to investigate intricate ferroelectric domains, their dynamic behavior, and endurance during electric field cycling in BaTiO3 (BTO) nanocrystals of varying sizes.
DOI: 10.15151/esrf-es-2177199493
title: Study of LaFeO3-based perovskite materials doped with Ni

description: Perovskite based materials such as LaFeO3, with sub-stoichiometric A-site and doped with different content of Ba, Ca, Ni, Mo, undergoing Ni exsolution on the surface are promising candidates as cathodes for Solid Oxide Fuel Cells (SOFCs). The catalytic activity, conductivity, and stability of the cathode can all be enhanced by introducing Ni nanoparticles on the perovskite surface. To rationally understand and optimize these materials, several experimental investigations can be conducted. We propose High-Resolution Fluorescence-Detected XANES (HERFD-XANES) to understand variations in the valences of B-site metals induced by A-site defectivity, measurements to elucidate the local distortion and mutual tilting of BO6 octahedra as a function of the concentration of exsolved Ni and the oxidation state of B-site metals.