ESM Software Software for Materials Science

SciPolymer 3

Properties estimated by SciPolymer

Volumetric:

  • molar volume
  • van der Waals volume
  • density

Thermodynamic:

  • glass transition temperature
  • molar heat capacity
  • Delta Cp at Tg
  • thermal decomposition, T1/2D

Transport:

  • thermal conductivity
  • viscosity
  • permeability - O2, N2, CO2

Cohesive Energy:

  • Coh1_Fedors-type
  • Coh2_van Krevelen-type
  • solubility parameter

Optical:

  • refractive index
  • molar refractive index

Electrical:

  • dielectric constant
  • molar polarization
  • effective dipole moment
  • dissipation factor

Magnetic:

  • molar magnetic susceptibility

Mechanical:

  • bulk modulus
  • Youngs modulus
  • shear modulus
  • surface energy
  • molar parachor

Conformational:

  • steric hindrance parameter
  • characteristic ratio
  • molar stiffness