User's manual for PANDA II: A computer code for calculating equations of state

Technical Report · Thu Jul 18 00:00:00 EDT 1991

OSTI ID:5306665

Kerley, G I

PANDA is an interactive computer code that is used to compute equations of state (EOS) for many classes of materials over a wide range of densities and temperatures. The first step in the development of a general EOS model is to determine the EOS for a one- component system, consisting of a single solid or fluid phase and a single chemical species. The results of several such calculations can then be combined to construct EOS for multiphase and multicomponent systems. For one-component solids and fluids, PANDA offers a variety of options for modeling various contributions to the EOS: the zero Kelvin isotherm, lattice vibrations, fluid degrees of freedom, thermal electronic excitation and ionization, and molecular vibrational and rotational degrees of freedom. Two options are available for computing EOS for multicomponent systems from separate EOS for the individual species and phases. The phase transition model is used for a system of immiscible phases, each having the same chemical composition. In the mixture model, the components can be either miscible or immiscible and can have different chemical compositions; mixtures cab be either inert or reactive. PANDA provides over 50 commands that are used to define the EOS models, to make calculations and compare the models to experimental data, and to generate and maintain tabular EOS libraries for use in hydrocodes and other applications. Versions of the code available for the Cray (UNICOS and CTSS), SUN (UNIX), and VAX(VMS) machines, and a small version is available for personal computers (DOS). This report describes the EOS models, use of the commands, and several sample problems. 92 refs., 7 figs., 10 tabs.

• Research Organization: Sandia National Labs., Albuquerque, NM (United States)
• Sponsoring Organization: USDOE; USDOE, Washington, DC (United States)
• DOE Contract Number: AC04-76DP00789
• OSTI ID: 5306665
• Report Number(s): SAND-88-2291; ON: DE91017717
• Country of Publication: United States
• Language: English

Related Subjects

71 CLASSICAL AND QUANTUM MECHANICS
GENERAL PHYSICS
99 GENERAL AND MISCELLANEOUS//MATHEMATICS, COMPUTING, AND INFORMATION SCIENCE
EQUATIONS OF STATE
P CODES
FLUIDS
IONIZATION
ISOTHERMS
MANUALS
PERTURBATION THEORY
PHASE DIAGRAMS
PHASE TRANSFORMATIONS
SOLIDS
VIBRATIONAL STATES
COMPUTER CODES
DIAGRAMS
DOCUMENT TYPES
ENERGY LEVELS
EQUATIONS
EXCITED STATES
657002* - Theoretical & Mathematical Physics- Classical & Quantum Mechanics
990200 - Mathematics & Computers