  Current paper presents the first attempt of the digitalization of a complex
polymerization process representing free-radical polymerization of vinyl
monomers in the presence of small additives of stable radicals TEMPO and C60
fullerene. Chain-reaction essence of the chemical process; quantum-chemical
concept of elementary reactions; digital-twin presentation of their
participants; virtual thermodynamic and kinetic descriptors of the latters;
digital polymeryzation passports of individually composed reaction solutions
lay the foundation of the digitalization carried out. Polymerization-passport
predictions made for a number of solutions with different vinyl monomers and/or
different initiating free radicals are fully consistent with chemical reality.
