TemperatureΒΆ

TEMPERATURE temperature {temperature_high ntemp}
temperature
Temperature (Kelvin) at which temperature the COSMO-RS calculation should take place. Default room temperature 298.15. The first temperature in case of a range of temperatures.
temperature_high
The last temperature (Kelvin) in case of a range of temperatures. Only used in case of solvent vapor pressure calculations or solubility calculations.
ntemp
The number of temperatures in case of a range of temperatures.