Tutoriel par Examples: chimique



from chempy import balance_stoichiometry # Main reaction in NASA's booster rockets: reac, prod = balance_stoichiometry({'NH4ClO4', 'Al'}, {'Al2O3', 'HCl', 'H2O', 'N2'}) from pprint import pprint pprint(reac) {'Al': 10, 'NH4ClO4': 6} pprint(prod) {'Al2O3': 5, 'H2O': 9, 'HCl': 6, 'N2': 3} ...
from chempy import Equilibrium from chempy.chemistry import Species water_autop = Equilibrium({'H2O'}, {'H+', 'OH-'}, 10**-14) # unit "molar" assumed ammonia_prot = Equilibrium({'NH4+'}, {'NH3', 'H+'}, 10**-9.24) # same here from chempy.equilibria import EqSystem substances = ...
from chempy import ReactionSystem # The rate constants below are arbitrary rsys = ReactionSystem.from_string("""2 Fe+2 + H2O2 -> 2 Fe+3 + 2 OH-; 42 2 Fe+3 + H2O2 -> 2 Fe+2 + O2 + 2 H+; 17 H+ + OH- -> H2O; 1e10 H2O -> H+ + OH-; 1e-4 Fe+3 + 2 H2O -...

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