.. _section-15.4:

Future Directions for Modeling Efforts.
---------------------------------------

.. _section-15.4.1:

Annular Molten Region
~~~~~~~~~~~~~~~~~~~~~

The current version of PINACLE models the formation of circular central
cavity within the fuel pin and the subsequent fuel relocation inside
this central cavity. Although the formation of such a central cavity is
likely in U-F metal pins and oxide fuel pins, the situation is different
for the U-Pu-Zr pins currently considered for the metal fuel core. In
the U-Pu-Zr pins the material redistribution, particularly the Zr
migration, leads to the formation of an annular Zr-depleted region, with
a melting point significantly lower than the central and outer fuel
regions. As the fuel pin temperature increases, the SAS4A calculations
for U-Pu-Zr pins may indicate the formation of an annular molten cavity,
due to the presence of this annular region with a low melting
temperature.

It is thus necessary to develop a PINACLE capability to treat the
formation of an annular cavity and to model the hydrodynamic fuel
relocation in an annular geometry. Furthermore, the heat transfer model
HTRVPN will have to be changed to accommodate the heat transfer
calculations in the central solid region and annular molten cavity. Once
this capability is developed it will be possible to use the results
calculated by the fuel redistribution modules, to obtain a more complete
picture of the U-Pu-Zr fuel pin behavior during the accident.

.. _figure-15.3-2:

..  figure:: media/image10.png
	:align: center
	:figclass: align-center

	Optional PINACLE Output

.. _section-15.4.2:

New Moving Material Components
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

The current in-pin hydrodynamic model describes the relocation of one
fuel component and two fission gas components, i.e., the free and
dissolved fission gas. The specific characteristics of the metal-fuel
pins will require the addition of several new material components, as
outlined below.

U-Pu-Zr fuel pins subjected to irradiation have a fuel composition that
is dependent on both the radial and axial location. The composition of
the molten fuel in the pin cavity will thus also depend on the initial
location of the molten material, as well as on the time dependent in-pin
material relocation and cavity extension. In order to describe this
situation two new fuel material components will be needed in PINACLE,
describing the Pu and Zr mass distribution, while the existing fuel
material will be used for the U fuel component. Only one homogenized
U-Pu-Zr composition will be present in the molten cavity at each axial
location, but this composition will vary with the axial location.

The metal-fuel porosity can be partially filled with small amounts of
liquid sodium originating from the original bond sodium used to fill the
fuel-cladding gap. As the fuel pin swells during irradiation and reaches
the cladding, much of the sodium relocates in the space above the fuel
column, but some of it might end up logged in the fuel porosity. The
presence of this sodium is taken into account now only in the
heat-transfer models, by using a modified solid fuel conductivity which
takes into account the presence of the porosity partially filled with
sodium. The sodium component, however, must be accounted for after the
occurrence of fuel melting, which will require the addition of a moving
Na component to the PINACLE hydrodynamic model. The presence of the
liquid sodium in the molten cavity will directly affect the physical
properties of the moving mixture. Although at the pressure levels
prevailing in the bottled cavity the liquid sodium is not expected to
have a major effect on the pressure, this situation can change after the
pin failure when the cavity pressure drops rapidly and the sodium vapor
pressure might play a significant role. Adding the liquid Na component
to the PINACLE hydrodynamic model will allow the modeling of the
prefailure in-pin axial sodium relocation and will provide the correct
initial conditions for the postfailure LEVITATE calculations.

A characteristic phenomenon in metal-fuel pins is the formation of a
molten eutectic layer at the fuel cladding interface. Iron diffuses
inwards into the fuel, leading to the formation of an alloy with a lower
solidus temperature than the original fuel and thus to fuel
liquefaction. This molten eutectic region progresses radially at the
same time as the central molten fuel cavity. When the molten fuel region
reaches the molten eutectic region the two molten components can mix and
axial relocation of the molten eutectic is possible. This situation is
not modeled currently. Although the formation of the cladding molten
eutectic region is taken into account in the DEFORM-5 cladding failure
calculations, the iron present in the molten fuel or cladding cannot
relocate axially or mix with the molten fuel. A moving cladding material
component will be needed in the PINACLE hydrodynamic model in order to
model the molten fuel and cladding mixing and axial relocation. The fuel
and cladding components interact chemically, resulting in a mixed molten
alloy. The mixing and interaction of the fuel and cladding directly
affects the physical properties of the molten moving mixture. The axial
relocation of the molten cladding material itself is expected to have a
small reactivity effect prior to cladding failure but, more importantly,
it will provide the correct initial conditions for the postfailure fuel
relocation, when rapid in-pin motion can lead to more significant
reactivity effects due to in-pin cladding relocation.

.. _section-15.4.3:

Inner Cladding Ablation
~~~~~~~~~~~~~~~~~~~~~~~

In metal-fuel pins the molten material region can extend radially past
the original inner cladding interface as the molten fuel region is
connected to the molten eutectic region. At present, the molten cavity
can extend only to the initial inner cladding interface and cladding
ablation can occur only at the outer cladding interface, after the
initiation of the postfailure fuel motion model LEVITATE. When the
molten cladding moving component is implemented, a model describing the
cladding ablation at the fuel-cladding interface will be necessary. This
model will allow the radius to increase past the original inner cladding
radius and will allow the mixing of the molten eutectic with the moving
components in the pin cavity as needed.

.. _section-15.4.4:

Composition-Dependent Moving Mixture Properties
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

The physical properties of the molten mixture in the cavity are
dependent on the material composition, i.e., the proportion of U, Pu, Zr
and Fe in the mixture. The physical properties affected by the
composition include the solidus and liquidus temperatures, the
conductivity, specific heat and density. Composition dependent functions
representing these physical properties will have to be implemented in
the PINACLE routines.

.. _section-15.4.5:

Fuel Freezing in the Plenum
~~~~~~~~~~~~~~~~~~~~~~~~~~~

The present model describes the radial heat-transfer between the fuel
ejected above the fuel-pin and the cladding. The heat-transfer model
will be expanded to describe the axial heat transfer between the molten
fuel and the liquid sodium slug. A fuel freezing model describing the
formation of a fuel crust in the gas plenum is already available in
PINACLE. However, the accuracy of this model is limited by the fact that
only one axial fuel cell, of variable length, is allowed above the
molten fuel-pin. This limitation was introduced mainly because of the
limited number of axial locations (24) available in SAS4A for the
fuel-pin arrays. In the future the models describing the molten,
heat-transfer and freezing of the ejected fuel will be expanded by
allowing the fuel region to cover multiple axial cells located above the
original fuel pin. A precondition for this development is an increase in
the size of the SAS4A fuel-pin arrays.

.. _section-15.4.6:

Initiation of Axial Motion
~~~~~~~~~~~~~~~~~~~~~~~~~~

The results of the TREAT experiment analyses performed with PINACLE,
such as TS-2, M2 and M3 series indicate that the temperature of the fuel
pin top interface is an important element for the prediction of the time
of onset of axial fuel ejection. However, it is likely that the pressure
difference between the molten fuel cavity and the upper gas plenum also
plays a role in the initiation of axial fuel ejection. The model
describing the onset of fuel motion will be enhanced in the future to
incorporate both the interface temperature and pressure difference
effects.

The timing of the in-pin molten fuel relocation initiation plays an
important role in determining the accident sequence. If the in-pin fuel
motion is initiated prior to cladding failure, a significant amount of
negative reactivity is added at a high rate, causing a rapid decrease in
power and reactivity. Thus, if cladding failure occurs later, it is
likely to occur at considerably lower power and reactivity levels. The
timing of the rapid in-pin fuel relocation initiation is determined by
the breach of the solid fuel at the top of the pin, which separates the
molten pressurized cavity from the gas plenum, usually at a lower
pressure. This event is influenced both the temperature distribution
near the top of the fuel pin and by the pressure difference between the
molten cavity and the gas plenum.

As present the fuel temperatures in the top axial fuel cell are used to
determine the timing of the onset of rapid in-pin fuel relocation. Only
a radial fuel distribution is calculated and any axial heat transfer is
neglected. However more detailed two-dimensional calculations indicate
that near the top of the fuel pin the axial heat transfer between the
fuel and the molten sodium present above the fuel pin becomes an
important element in determining the temperature distribution. Because
the top of the solid fuel pin actually controls the onset of rapid
in-pin molten fuel relocation, it is necessary to implement at
two-dimensional temperature calculation in the top axial fuel cell.

It is likely that the pressure difference between the molten cavity and
the upper gas plenum also plays a role in the initiation of the axial
fuel upward ejection. The current models do not take into account this
pressure difference in the initiation of in-pin rapid fuel relocation,
although the pressure difference is considered in the hydrodynamic
models and plays an important role in determining the rate of fuel
ejection after the onset of in-pin fuel relocation. The model describing
the onset of rapid molten fuel motion will be enhanced in the future to
incorporate the pressure difference effects in addition to the fuel
temperature distribution.

.. _section-15.4.7:

Fuel Blanket and Sodium Slug Motion
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

A separate momentum equation describing the motion of the fuel blanket
stack and/or liquid sodium slug will be added. Currently, this stack is
modeled as moving together with the molten fuel until it reaches a rigid
obstacle. Afterwards, the stack is assumed immobile and the fuel
ejection is governed by the pressure difference between the upper cavity
cell and the cell above the fuel pin. Although the current treatment is
physically justified and necessary, for numerical stability reasons,
when the amount of molten fuel ejected is small, the addition of a
separate momentum equation for the pellet stack and/or liquid sodium
slug will significantly increase the flexibility of the model when
calculating the ejection of larger amounts of molten fuel above the
active fuel column.

At present, the calculations describing the transient temperatures of
the liquid sodium slug and fission gas plenum continue after the
initiation of the rapid in-pin fuel relocation, ignoring the boundary
heat-transfer changes due to the sodium slug relocation.

In fact the sodium slug is moving upwards, and thus the surrounding
cladding temperatures change, leading to different heat fluxes. In
addition, the axial heat transfer occurring at the lower slug boundary
between the liquid sodium and molten fuel is likely to be significant.
In the case of the fission gas, the upward motion of the sodium slug
causes a decrease of the fission gas volume and boundary area. While the
volume decrease is now accounted for in the pressure calculations, the
heat-transfer model must be modified to account for the changes in the
cladding area in contact with the plenum gas.

.. _section-15.4.8:

PINACLE Termination Upon Fuel Freezing and Restart Upon Remelting
~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

For the examination of transients with decreasing power levels after the
initiation of PINACLE, the addition of the capability of modeling fuel
freezing in the pin cavity will also be necessary. In order to allow the
analysis of long transients even after PINACLE has been initiated, it is
necessary to develop the capability of discontinuing the PINACLE
calculations whenever the fuel in the pin cavity freezes again and
restarting the PINACLE calculations at a later time if necessary. This
will allow the SAS4A calculations to proceed with significantly larger
time steps.