This is the Linux app named OpenThermo whose latest release can be downloaded as OpenThermo-1.0.0b1_setup.exe. It can be run online in the free hosting provider OnWorks for workstations.
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SCREENSHOTS:
OpenThermo
DESCRIPTION:
OpenThermo is a program package for statistical thermodynamics computations beyond rigid rotor - harmonic oscillator approximation
Features
- Evaluation of thermodynamic properties from molecular data
- Automatic symmetry analysis for molecule and internal rotors
- Verbose log file makes thermodynamic calculation more transparent
- Treatment of internal rotations in quantum or classic approaches
- Calculation of reduced inertial moments of balanced and non-balanced internal rotors
- Automatic Fourier interpolation of discreetly defined potential bariers
- Calculations with anharmonic correction
Audience
Education, End Users/Desktop, Science/Research
User interface
Command-line, Console/Terminal
Programming Language
C++
Categories
This is an application that can also be fetched from https://sourceforge.net/projects/openthermo/. It has been hosted in OnWorks in order to be run online in an easiest way from one of our free Operative Systems.