CL20250803_AnalyzePXRD

Type: Python Script (py, pkl, zip, ipynb)

ObjectId: 29162

Created: 8/8/2025 11:16:43 AM by A09) Leppin Christian [christian.leppin@rub.de]

Updated: 10/5/2025 4:49:11 PM by A09) Leppin Christian [christian.leppin@rub.de]

Access: Public Sort Code (asc): 20

Description: Python notebook to carry out the analysis of the PXRD pattern and calculate the pattern for bulk Co3O4 from CIF file (1526734)[1]. [1] Kotousova, I. S.; Polyakov, S. M. Electron diffraction study of Co3O4. Kristallografiya 1972, 17 (3), 661.

File attached: CL20250803_AnalyzePXRD.ipynb 65.2 Kb

Associated Objects

No associated objects found.

Referenced Objects (Reverse Association)

  • cpy_131_repro_calc
    Sample

    The nanoparticles were provided from the Schulz-Group. Synthesis description: For the synthesis of spherical Co3O4 nanoparticles, 1.164 g Co(NO3)2·6 H2O (4.0 mmol) was dissolved in 200 mL water in an open reactor vessel. Subsequently, 3.24 mL of ammonium hydroxide solution and 240 µL of H2O2 were added. The black reaction mixture was then heated to 60 °C for 15 minutes. A solution containing 0.58 g Co(NO3)2·6 H2O (2 mmol) dissolved in 80 mL water was added and the reaction temperature was maintained at 60 °C for 3 hours. After cooling to room temperature, the nanoparticles were collected by centrifugation at 3000 rpm, washed with water and acetone and dried in air. The particles were then heated at a rate of 4.5 °C min-1 to 300 °C, where the temperature was maintained for 15 minutes before cooling to room temperature.

All properties (except table)

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The table

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