Dataset Open Access

Raw Data of Pilot Plant Runs for CONSENS Project (Case Study 1)

Simon Kern; Lukas Wander; Klas Meyer; Svetlana Guhl; Anwesh Reddy Gottu Mukkula; Manuel Holtkamp; Malte Salge; Christoph Fleischer; Nils Weber; Rudibert King; Sebastian Engell; Andrea Paul; Manuel Pereira Remelhe; Michael Maiwald


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    "title": "Raw Data of Pilot Plant Runs for CONSENS Project (Case Study 1)", 
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        "title": "Integrated Control and Sensing for Sustainable Operation of Flexible Intensified Processes", 
        "acronym": "CONSENS", 
        "program": "H2020", 
        "funder": {
          "doi": "10.13039/501100000780", 
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      "Process Analytical Technology", 
      "Multivariate Data Analysis", 
      "Nuclear Magnetic resonance", 
      "Near Infrared Spectroscopy", 
      "Continuous Manufacturing"
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    "publication_date": "2018-09-28", 
    "creators": [
      {
        "orcid": "0000-0002-5092-1591", 
        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Simon Kern"
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        "orcid": "0000-0003-4558-6140", 
        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Lukas Wander"
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      {
        "orcid": "0000-0003-1837-3801", 
        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Klas Meyer"
      }, 
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        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Svetlana Guhl"
      }, 
      {
        "orcid": "0000-0002-1769-6214", 
        "affiliation": "Dortmund University of Technology", 
        "name": "Anwesh Reddy Gottu Mukkula"
      }, 
      {
        "affiliation": "INVITE GmbH", 
        "name": "Manuel Holtkamp"
      }, 
      {
        "affiliation": "INVITE GmbH", 
        "name": "Malte Salge"
      }, 
      {
        "affiliation": "INVITE GmbH", 
        "name": "Christoph Fleischer"
      }, 
      {
        "affiliation": "Bayer AG", 
        "name": "Nils Weber"
      }, 
      {
        "orcid": "0000-0002-0997-0498", 
        "affiliation": "Berlin University of Technology", 
        "name": "Rudibert King"
      }, 
      {
        "affiliation": "Dortmund University of Technology", 
        "name": "Sebastian Engell"
      }, 
      {
        "orcid": "0000-0003-2849-4754", 
        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Andrea Paul"
      }, 
      {
        "affiliation": "Bayer AG", 
        "name": "Manuel Pereira Remelhe"
      }, 
      {
        "orcid": "0000-0003-4309-728X", 
        "affiliation": "Bundesanstalt f\u00fcr Materialforschung und \u2013pr\u00fcfung (BAM)", 
        "name": "Michael Maiwald"
      }
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    "description": "<p>In&nbsp;case study one of the CONSENS project, two aromatic substances were coupled by a lithiation reaction, which is a prominent example in pharmaceutical industry. The two aromatic reactants (Aniline and <em>o</em>-FNB) were mixed with Lithium-base (LiHMDS)&nbsp;in a continuous modular plant&nbsp;to produce the desired product (Li-NDPA) and a salt (LiF). The salt precipitates which leads to the formation of particles. The feed streams were&nbsp;subject to&nbsp;variation to drive the plant to its optimum.&nbsp;</p>\n\n<p>The uploaded data comprises the results from four days during continuous plant operation time. Each day is denoted from day 1-4 and represents the dates 2017-09-26,&nbsp;2017-09-28,&nbsp;2017-10-10,&nbsp;2017-10-17.</p>\n\n<p>In the following the contents of the files are explained.</p>\n\n<p><strong>NIR_data_AQ15_raw.zip: </strong>Contains Bruker binary files (0-Files)&nbsp;of NIR spectrometer at AQ15 (Location is located subsequently to NMR spectrometer)</p>\n\n<p><strong>NMR_spectra_raw.zip:&nbsp;</strong>Contains Spinsolve files (Binarys of&nbsp;FID and Spectrum, DX-Files) of NMR spectrometer. The use of DX-files files is not recommended.</p>\n\n<p><strong>PCS_data_csv.zip</strong>: Contains csv-files of the process control system (PCS) including data of mass flow controlers (*_Bilanz.csv),&nbsp;filling level (*_FillLe.csv), pressures (*_pres), temperatures (*_Temp), position of valves (*_Valves). Relevant labels are: BP13 = LiHMDS&nbsp;storage tank, BP12 = aniline storage tank, BP12 = <em>o</em>-FNB storage tank, CM003 and CM004 = tubular reactors, T0041 and T005 = Temperature at reactor exits, P009 and P003 = Pressure at reactor inlets, P006 = Pressure at reactor exits.</p>\n\n<p><strong>housing_data_NMR.csv</strong>: Contrains data of NMR enclosure of all four days. Each columns from left to right represent timestamps, bypass pressure (bar), bypass temperature (&deg;C), Gasalarm (logical), bypass actual flowrate (g&nbsp;min<sup>-1</sup>),&nbsp; bypass flowrate setpoint (g&nbsp;min<sup>-1</sup>), bypass density (kg&nbsp;m<sup>3</sup>)</p>\n\n<p><strong>matlab_variables_explanation.xlsx</strong>: Explanation of variables used in matlab structure &quot;data_validation_run&quot;.</p>\n\n<p><strong>data_validation_run.mat</strong>: Matlab structure containing most relevant process data including NMR results, NIR results, housing data of NMR, and process control system data.</p>"
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