cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/ccdc.csd.cc25cn07
title: CCDC 2007188: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn18
title: CCDC 2007189: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn29
title: CCDC 2007190: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn3b
title: CCDC 2007191: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn4c
title: CCDC 2007192: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn5d
title: CCDC 2007193: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn6f
title: CCDC 2007194: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn7g
title: CCDC 2007195: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn8h
title: CCDC 2007196: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cn9j
title: CCDC 2007197: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnbk
title: CCDC 2007198: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cncl
title: CCDC 2007199: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cndm
title: CCDC 2007200: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnfn
title: CCDC 2007201: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cngp
title: CCDC 2007202: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnhq
title: CCDC 2007203: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnjr
title: CCDC 2007204: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnks
title: CCDC 2007205: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnlt
title: CCDC 2007206: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnmv
title: CCDC 2007207: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnnw
title: CCDC 2007208: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnpx
title: CCDC 2007209: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnqy
title: CCDC 2007210: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnrz
title: CCDC 2007211: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cns0
title: CCDC 2007212: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnt1
title: CCDC 2007213: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.cc25cnv2
title: CCDC 2007214: Experimental Crystal Structure Determination

description: Related Article: W.F. Sanjuan-Szklarz, M. Woińska, S. Domagała, P.M. Dominiak, S. Grabowsky, D. Jayatilaka, M. Gutmann, K. Woźniak|2020|IUCrJ|7|920|doi:10.1107/S2052252520010441
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.20277559
title: Three-dimensional CFD analysis of liquid slug acceleration and impact in a voided pipeline with end orifice

description: This research describes the dynamic behavior of an isolated slug driven by pressurized air in a voided line with an end orifice. A three-dimensional (3D) computational-fluid-dynamics (CFD) model is used to simulate the rapid propulsion and impact at the orifice for given slug length and driving air pressure, and is validated against experimental data. New mechanisms are observed: (<i>i</i>) the driving air pressure at the slug tail decreases with the slug motion; (<i>ii</i>) when the slug arrives at the orifice, the air fraction is almost one hundred percent in the most upstream part of the pipe, then it attenuates rapidly until an invariant eighty percent is achieved with a constant mass shedding rate; (<i>iii</i>) the velocity distribution in the radial direction of the cross-section at the midpoint of the slug length evolves from uniform to trapezoidal and then to logarithmic during slug movement; (<i>iv</i>) the initial vertical slug front changes its shape due to air intrusion at the top of the slug front; (<i>v</i>) the slug’s acceleration decreases first and then increases under the combined effects of its decreasing mass, nonlinear attenuation of the driving pressure, and increasing skin friction; (<i>vi</i>) the slug length has a constant rate of decrease.
DOI: 10.6084/m9.figshare.20277559.v1
title: Three-dimensional CFD analysis of liquid slug acceleration and impact in a voided pipeline with end orifice

description: This research describes the dynamic behavior of an isolated slug driven by pressurized air in a voided line with an end orifice. A three-dimensional (3D) computational-fluid-dynamics (CFD) model is used to simulate the rapid propulsion and impact at the orifice for given slug length and driving air pressure, and is validated against experimental data. New mechanisms are observed: (<i>i</i>) the driving air pressure at the slug tail decreases with the slug motion; (<i>ii</i>) when the slug arrives at the orifice, the air fraction is almost one hundred percent in the most upstream part of the pipe, then it attenuates rapidly until an invariant eighty percent is achieved with a constant mass shedding rate; (<i>iii</i>) the velocity distribution in the radial direction of the cross-section at the midpoint of the slug length evolves from uniform to trapezoidal and then to logarithmic during slug movement; (<i>iv</i>) the initial vertical slug front changes its shape due to air intrusion at the top of the slug front; (<i>v</i>) the slug’s acceleration decreases first and then increases under the combined effects of its decreasing mass, nonlinear attenuation of the driving pressure, and increasing skin friction; (<i>vi</i>) the slug length has a constant rate of decrease.
DOI: 10.6084/m9.figshare.18805516
title: Numerical investigation of turbulent forced convection flow in a two-dimensional curved surface cavity

description: A numerical study was carried out to investigate the thermal and flow fields of a two-dimensional vented cavity subjected to forced convection turbulent flow. The cavity with three distinct configurations of inlet and outlet ports having three different cases of top surfaces, i.e. flat, semi-elliptical and semi-circular was studied numerically for a range of Reynolds numbers. The objective of the study is to investigate the effect of the top curved wall surface on heat transfer in different configurations of inlet and outlet ports. The various results were presented for streamlines and thermal fields. The variations in the pressure-drop coefficient, local Nusselt number and average Nusselt number were also evaluated. The results show the significant dependence of heat exchange and pressure drop on Reynolds number, location of ports, and the height of the top curved wall surface. The rate of heat transfer was enhanced by increasing the height of the curved surface, but relatively high-pressure drop was observed in top curved surface cavity for the given Reynolds number. On the contrary, the semi-elliptical top surface cavity with inlet and outlet ports positioned on the same axis, displayed an improved performance in terms of maximum average Nusselt number and minimum pressure drop.
DOI: 10.6084/m9.figshare.21824757
title: Fig. S2 - Localization of LptD

description: This folder contains the excel data used in the graphs found in Fig. S2b and S2c and the GraphPad Prism file used to generate the graphs.
DOI: 10.6084/m9.figshare.21824757.v4
title: Fig. S2 - Localization of LptD

description: This folder contains the excel data used in the graphs found in Fig. S2b and S2c and the GraphPad Prism file used to generate the graphs.
DOI: 10.6084/m9.figshare.21824757.v3
title: Fig. S2 - localization of LptD

description: This file consists of the excel data used in the graphs found in Fig. S2b and S2c and the GraphPad Prism file used to generate the graphs.