cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5517/cc136w06
title: CCDC 1019497: Experimental Crystal Structure Determination

description: Related Article: Jing Chen, Chao Chen, Junjie Chen, Guohua Wang, Hongmei Qu|2015|Chem.Commun.|51|1356|doi:10.1039/C4CC08363F
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.cc136ymw
title: CCDC 1019578: Experimental Crystal Structure Determination

description: Related Article: Meng-Yang Chang, Chung-Yu Tsai, Chieh-Kai Chan|2015|Tetrahedron|71|424|doi:10.1016/j.tet.2014.12.012
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/cc136xlt
title: CCDC 1019546: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xgp
title: CCDC 1019542: Experimental Crystal Structure Determination

description: Related Article: Roy N. McDougald Junior,  Bhaskar Chilukuri,  Huiping Jia,  Michael R. Perez,  Hassan Rabaa,  Xiaoping Wang,  Vladimir N. Nesterov,  Thomas R. Cundari,  Bruce E. Gnade, Mohammad A. Omary|2014|Inorg.Chem.|53|7485|doi:10.1021/ic500808q
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/cc136xmv
title: CCDC 1019547: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xnw
title: CCDC 1019548: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xhq
title: CCDC 1019543: Experimental Crystal Structure Determination

description: Related Article: Roy N. McDougald Junior,  Bhaskar Chilukuri,  Huiping Jia,  Michael R. Perez,  Hassan Rabaa,  Xiaoping Wang,  Vladimir N. Nesterov,  Thomas R. Cundari,  Bruce E. Gnade, Mohammad A. Omary|2014|Inorg.Chem.|53|7485|doi:10.1021/ic500808q
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/cc136xpx
title: CCDC 1019549: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xjr
title: CCDC 1019544: Experimental Crystal Structure Determination

description: Related Article: Roy N. McDougald Junior,  Bhaskar Chilukuri,  Huiping Jia,  Michael R. Perez,  Hassan Rabaa,  Xiaoping Wang,  Vladimir N. Nesterov,  Thomas R. Cundari,  Bruce E. Gnade, Mohammad A. Omary|2014|Inorg.Chem.|53|7485|doi:10.1021/ic500808q
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.zq88w3
title: Occurrence Download

description: A dataset containing 282 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is Human Observation",
 "CoordinateUncertaintyInMeters 0.0-10000.0",
 "Country is United States of America",
 "TaxonKey is Potamopyrgus antipodarum"
 ]
}

 The dataset includes 282 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0051049-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc136xks
title: CCDC 1019545: Experimental Crystal Structure Determination

description: Related Article: Roy N. McDougald Junior,  Bhaskar Chilukuri,  Huiping Jia,  Michael R. Perez,  Hassan Rabaa,  Xiaoping Wang,  Vladimir N. Nesterov,  Thomas R. Cundari,  Bruce E. Gnade, Mohammad A. Omary|2014|Inorg.Chem.|53|7485|doi:10.1021/ic500808q
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/cc136xqy
title: CCDC 1019550: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xrz
title: CCDC 1019551: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xs0
title: CCDC 1019552: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xt1
title: CCDC 1019553: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xv2
title: CCDC 1019554: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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.su9tfg
title: Occurrence Download

description: A dataset containing 18 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Fallopia baldschuanica",
 "HasCoordinate is true",
 "Country is Hungary"
 ]
}

 The dataset includes 18 records from 4 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0051050-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5517/cc120p1t
title: CCDC 983755: Experimental Crystal Structure Determination

description: Related Article: Walid Rekik, Nouha Loulou Nkhili, Houcine Naïli, and Slimane Dahaoui|2014|Z.Anorg.Allg.Chem.|640|2603|doi:10.1002/zaac.201400240
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/cc136xw3
title: CCDC 1019555: Experimental Crystal Structure Determination

description: Related Article: Wesley D. Morris,  Peter T. Wolczanski,  Jörg Sutter,  Karsten Meyer,  Thomas R. Cundari,  and Emil B. Lobkovsky|2014|Inorg.Chem.|53|7467|doi:10.1021/ic500807y
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/cc136xx4
title: CCDC 1019556: Experimental Crystal Structure Determination

description: Related Article: John C. Ahern,  Ryan J. Roberts,  Philip Follansbee,  Jeffrey McLaughlin,  Daniel B. Leznoff,  and Howard H. Patterson|2014|Inorg.Chem.|53|7571|doi:10.1021/ic500890r
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.16918499
title: Replication Kit for the Review of a Double-Slit Experiment

description: This replication kit provides all materials needed to independently verify analyses from my 2012 arXiv publication on the double-slit diffraction experiment. No claim about intent is made or implied. It demonstrates how reported results can be regenerated by applying software-only operations to FFT spectra rather than by physical processes. The most serious finding is that fractional spectral shifts can be combined to simulate the published standardized ratio graph (R′), indistinguishable from a physical effect.

The kit includes:





Publications (PDFs): 2012 arXiv paper, initial critique, and camera specifications.




PowerPoint (PDFs): Estimation of fringe spacing and visibility, FFT spectral analysis, and demonstrations of spectral shifts.




Word (PDFs): Calculations of the spectral measure R, calibration of FFT frequency units, derivation of slit-to-camera distance, and overview of parameter inconsistencies.




Graphs (JPGs): Central diffraction pattern, fringe spacing, original vs. shifted FFT spectra, and spectral positions for alternative distances.




README (Executive Summary): Purpose, key findings, replication steps, and ethical note.



Key results highlighted in the kit include:





Demonstration that combining fractional spectral shifts can reproduce the published standardized ratio graph (R′), creating false evidence of a physical effect that actually arises from software manipulation.




Identification of a systematic 1 wavenumber (w/n) shift in the FFT spectrum.




Absence of the zero-frequency (DC) component in the published spectrum.




Inconsistencies in reported experimental parameters (pixel size, slit-to-camera distance).




Agreement between visibility derived from the diffraction pattern (0.60) and the reinstated FFT spectrum, contrasting with the artificially lowered visibility (0.16) in the published FFT.




Demonstration that a 1 w/n shift reduces the key measure R by up to 93%, showing how small manipulations can manufacture a result.



This kit is intended for independent replicators and research integrity bodies. It demonstrates how spectral analysis can be used to verify reported results and to detect artifacts that may arise from post-processing or misrepresentation of optical data.
description: (C) 2025 Fotini Pallikari. Licensed under Creative Commons Attribution 4.0 International (CC BY 4.0).

For clarity, all original files are provided as PDFs and JPGs, organized into four folders (A–D) with a README overview. The kit is distributed as a single ZIP archive to preserve structure.
DOI: 10.5281/zenodo.16918500
title: Replication Kit for the Review of a Double-Slit Experiment

description: This replication kit provides all materials needed to independently verify analyses from my 2012 arXiv publication on the double-slit diffraction experiment. It demonstrates how reported results can be reproduced through software manipulation of FFT spectra rather than by physical processes. The most serious finding is that fractional spectral shifts can be combined to simulate the published standardized ratio graph (R′), creating false evidence of a physical effect.

The kit includes:





Publications (PDFs): 2012 arXiv paper, initial critique, and camera specifications.




PowerPoint (PDFs): Estimation of fringe spacing and visibility, FFT spectral analysis, and demonstrations of spectral shifts.




Word (PDFs): Calculations of the spectral measure R, calibration of FFT frequency units, derivation of slit-to-camera distance, and overview of parameter inconsistencies.




Graphs (JPGs): Central diffraction pattern, fringe spacing, original vs. shifted FFT spectra, and spectral positions for alternative distances.




README (Executive Summary): Purpose, key findings, replication steps, and ethical note.



Key results highlighted in the kit include:





Demonstration that combining fractional spectral shifts can reproduce the published standardized ratio graph (R′), creating false evidence of a physical effect that actually arises from software manipulation.




Identification of a systematic 1 wavenumber (w/n) shift in the FFT spectrum.




Absence of the zero-frequency (DC) component in the published spectrum.




Inconsistencies in reported experimental parameters (pixel size, slit-to-camera distance).




Agreement between visibility derived from the diffraction pattern (0.60) and the reinstated FFT spectrum, contrasting with the artificially lowered visibility (0.16) in the published FFT.




Demonstration that a 1 w/n shift reduces the key measure R by up to 93%, showing how small manipulations can manufacture a result.



This kit is intended for independent replicators and research integrity bodies. It demonstrates how spectral analysis can be used to verify reported results and to detect artifacts that may arise from post-processing or misrepresentation of optical data.
description: (C) 2025 Fotini Pallikari. Licensed under Creative Commons Attribution 4.0 International (CC BY 4.0).

For clarity, all original files are provided as PDFs and JPGs, organized into four folders (A–D) with a README overview. The kit is distributed as a single ZIP archive to preserve structure.
DOI: 10.5517/cc136xy5
title: CCDC 1019557: Experimental Crystal Structure Determination

description: Related Article: John C. Ahern,  Ryan J. Roberts,  Philip Follansbee,  Jeffrey McLaughlin,  Daniel B. Leznoff,  and Howard H. Patterson|2014|Inorg.Chem.|53|7571|doi:10.1021/ic500890r
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/cc136xz6
title: CCDC 1019558: Experimental Crystal Structure Determination

description: Related Article: John C. Ahern,  Ryan J. Roberts,  Philip Follansbee,  Jeffrey McLaughlin,  Daniel B. Leznoff,  and Howard H. Patterson|2014|Inorg.Chem.|53|7571|doi:10.1021/ic500890r
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/cc136y08
title: CCDC 1019559: Experimental Crystal Structure Determination

description: Related Article: John C. Ahern,  Ryan J. Roberts,  Philip Follansbee,  Jeffrey McLaughlin,  Daniel B. Leznoff,  and Howard H. Patterson|2014|Inorg.Chem.|53|7571|doi:10.1021/ic500890r
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/cc136y19
title: CCDC 1019560: Experimental Crystal Structure Determination

description: Related Article: Tharushi A. Perera,  Mehdi Masjedi,  and Paul R. Sharp|2014|Inorg.Chem.|53|7608|doi:10.1021/ic5009413
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/cc136y2b
title: CCDC 1019561: Experimental Crystal Structure Determination

description: Related Article: Tharushi A. Perera,  Mehdi Masjedi,  and Paul R. Sharp|2014|Inorg.Chem.|53|7608|doi:10.1021/ic5009413
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/cc136y3c
title: CCDC 1019562: Experimental Crystal Structure Determination

description: Related Article: Tharushi A. Perera,  Mehdi Masjedi,  and Paul R. Sharp|2014|Inorg.Chem.|53|7608|doi:10.1021/ic5009413
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/cc136y4d
title: CCDC 1019563: Experimental Crystal Structure Determination

description: Related Article: Jonathan A. Bailey,  Marten Ploeger,  and Paul G. Pringle|2014|Inorg.Chem.|53|7763|doi:10.1021/ic501133n
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/cc136y5f
title: CCDC 1019564: Experimental Crystal Structure Determination

description: Related Article: Jonathan A. Bailey,  Marten Ploeger,  and Paul G. Pringle|2014|Inorg.Chem.|53|7763|doi:10.1021/ic501133n
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/cc136y6g
title: CCDC 1019565: Experimental Crystal Structure Determination

description: Related Article: Jonathan A. Bailey,  Marten Ploeger,  and Paul G. Pringle|2014|Inorg.Chem.|53|7763|doi:10.1021/ic501133n
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.