Solution basesection

[budschi]

we need a basesection that handles solutions. That means adding Components to CompositeSystem by volume and weight. E.g.:

Solution 1: 
  - 0.1004 g (NH4)2HPO4 
  - 20 ml H2O

So far we can only add Components by weight.

[aalbino2]

basesection development. @budschi @hampusnasstrom

doublecheck:

• hysprint Micha
• Chemotion

Solution_preparation(Activity):
  m_def: template
  name:
  description:
  atmosphere:
  intended_sample_conc:
  obtained_conc:
  intended_tot_volume:
  obtained_tot_volume:
  steps:
    weighing:
      component(Component): 
      alias: (default value)
      container_mass:
      net_mass:
      brutto_mass:
      molecular_weight:
    pipetting: (better word)
      component(Component): 
      alias: (default value)
      measured_volume:
      density:
      container_mass:
      net_mass:
      brutto_mass:
      molecular_weight:
    mixing:
      mixed_aliases:
      alias: (default value based on mixed_aliases)
      mixing_time:
      container_type:
      temperature:
      rotation_speed:

[budschi]

• Discussion on standard synthesis processes in Area A TF 29.1.2024:
  • Solution basesection #10
  • Weighing
  • powder
    • can be done with existing CompositeSystem
  • Solution
    • Solvent + Disolvent
    • volume, density
    • search for name of molecule as a compound
    • incubation parameters
    • Subclass of buffer solution?
  • Solution pprep
    • add component: mass, volume
    • incubation pa

Solution_preparation(Activity):
	    m_def: template  
	    name:  
	    description:  
	    atmosphere:  
	    intended_sample_conc:  
	    obtained_conc:  
	    intended_tot_volume:  
	    obtained_tot_volume:  
	    steps: (repeating)  
	      weighing:  
	        component(Component):   
	        alias: (default value)  
	        container_mass:  
	        net_mass:  
	        brutto_mass:  
	        molecular_weight:  
	      volume measuring (pipetting): (better word)  
	        component(Component):   
	        alias: (default value)  
	        measured_volume:  
	        density:  
	        container_mass:  
	        net_mass:  
	        brutto_mass:  
	        molecular_weight:  
	      mixing:  
	        mixed_aliases:  
	        alias: (default value based on mixed_aliases)  
	        mixing_time:  
	        container_type:  
	        temperature:  
	        rotation_speed:  
	        atmosphere:  
	        combination speed (adding speed?)  

• titration: add x until y is equal z

• setting a ph value , drop-wise adding

• check what Chemotion offers regading Solution an powder preparation

• MOF preparation Dinga

• Hysprint

• nice to have features:

  • concentration of compounds, molar ratio, mass per volume
  • calculator (Chemotion?)
  • simple table that can be parsed

• issue about versioning of ELN entry! (Who changed what in an ELN entry) --> timestamp --> important for patents

• make use topology to separate out solvent and

[aalbino2]

I have another solution preparation example, it is for now as received from a user:
https://github.com/FAIRmat-NFDI/AreaA-data_modeling_and_schemas/blob/main/IKZ_plugin/src/movpe_IKZ/schema.py

The class is PrecursorsPreparationMovpe1IKZ

let's discuss this together to see how we can design it in the best way to be light and effective @hampusnasstrom @budschi !