Agent skill

doublet

Validates code and provides physics reasoning for the 2-D injection-production doublet model using streamline methods. Use when modifying streamline geometry, transport calculations (hydrodynamic, chemical, thermal), breakthrough curves, or Green's function kernels. Also use when debugging simulation behavior or explaining physics concepts.

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Install this agent skill to your Project

npx add-skill https://github.com/majiayu000/claude-skill-registry/tree/main/skills/data/doublet

SKILL.md

Doublet Streamline Model Physics Knowledge

This skill provides physics knowledge for the 2-D doublet (injection-production well pair) model using streamline methods. The model solves advection-reaction-dispersion problems along circular streamlines in a potential flow field.

When This Skill Applies

  • Modifying streamline geometry calculations (bipolar coordinates)
  • Changing transport solvers (hydrodynamic, chemical, thermal)
  • Implementing or modifying breakthrough curve integration
  • Working with Green's function kernels for thermal transport
  • Debugging unexpected breakthrough behavior
  • Planning changes to physics-related code
  • Explaining why the model behaves a certain way

Core Physics Reference

The model tracks transport in a 2-D potential flow field between an injector (+a, 0) and producer (-a, 0):

Module Transport Type Solution Method
Hydrodynamic Pure advection Time-of-flight along streamlines
Chemical Advection + capacity-limited reaction Logistic traveling wave
Thermal Advection + fluid-matrix exchange Bessel-function Green's kernel

Key state variables:

Variable Symbol Meaning Units
Take-off angle β Angle at which streamline leaves injector rad
Time-of-flight τ(β) Travel time from injector to producer s
Arc position φ Angle along circular streamline rad
Concentration C(φ,t) Solute mass fraction kg/kg
Capacity S(φ,t) Remaining reaction capacity kg/kg
Fluid temperature Tf(φ,t) Fluid temperature along streamline °C
Matrix temperature Tm(φ,t) Rock matrix temperature °C

For detailed equations, see EQUATIONS.md. For symbol definitions and units, see SYMBOLS.md. For derivation logic, see DERIVATIONS.md. For edge cases and sanity checks, see SANITY_CHECKS.md.


Workflow A: Physics Validation

Use this workflow when reviewing or planning code changes.

Step 1: Identify affected transport type

Determine which transport physics is affected:

  • Hydrodynamic: Streamline geometry, time-of-flight, velocity field
  • Chemical: Capacity-limited reaction, logistic traveling wave
  • Thermal: Fluid-matrix exchange, Bessel function kernel

Step 2: Check coordinate system consistency

The model uses multiple coordinate systems:

  • Cartesian (x, y) for plotting
  • Bipolar (ξ, β) for streamline parameterization
  • Polar about streamline center (R, φ) for local calculations

Verify transformations are applied correctly.

Step 3: Verify breakthrough integration

Breakthrough curves integrate over all streamlines:

C_prod(t) = (1/π) ∫_0^π C(β, t) dβ

Check that:

  • Integration weights are correct (trapezoidal or custom)
  • β limits span [0, π] (or arrived streamlines only)
  • Singularities at β → 0, π are handled

Step 4: Check Green's function stability (thermal)

For thermal transport, the Bessel kernel G(τ, t) can overflow:

  • Verify exponent recentering is applied
  • Check that i1e (scaled Bessel I1) is used instead of i1
  • Verify prefix integrals use cumulative_trapezoid

Step 5: Report findings

Summarize:

  • Which transport type is affected
  • Any coordinate transformation issues
  • Any integration boundary issues
  • Any numerical stability concerns
  • Recommendations for correction

Workflow B: Physics Reasoning

Use this workflow when explaining behavior, debugging, or proposing solutions.

For explaining physics concepts:

  1. Identify the relevant equations and parameters
  2. State the physical interpretation
  3. Explain cause-and-effect relationships
  4. Use the derivation steps from DERIVATIONS.md to show connections

For debugging simulation issues:

  1. Identify which transport type shows unexpected behavior
  2. Check if the issue relates to:
    • Breakthrough timing (τ calculation)
    • Front retardation (reaction capacity)
    • Thermal lag (fluid-matrix exchange rates)
  3. Trace through the analytical solution
  4. Check edge cases against SANITY_CHECKS.md

For proposing physics-consistent changes:

  1. Identify which equations are affected
  2. Show how new terms integrate into the transport equations
  3. Demonstrate that mass/energy balance is preserved
  4. Identify any new sanity checks needed

Quick Reference: Module Structure

Module Purpose Key Functions
doublet.py Main model (streamlines, chemical, thermal) Tf, Ctf, Cxf, Ttf, Txf, breakthrough
streamlines.py Bipolar coordinate streamlines streamline_bipolar, streamtube_width
diffusion.py Green's kernel solver with diffusion solve_kernel_capacity, cxfD, ctDf
thermal.py Thermal kernel (alternative impl.) thermal_kernel_Tf_Tm_xvec_t
thermal2.py Optimized thermal solver G_grid_efficient, run_breakthrough, Tprodf
notebook_widgets.py Interactive Jupyter visualizations visualize_* functions

Key Physical Constraints

These must always hold:

  1. Streamline geometry: Streamlines are circular arcs through (±a, 0)
  2. Travel time bounds: T(β=0) = 4πna²/(3Q) is minimum arrival time
  3. Velocity singularity: v → ∞ at wells (handled by coordinate transformation)
  4. Conservation: Integrated flux across all streamlines equals Q
  5. Retardation: Chemical front travels at speed v·C_inj/(C_inj + S_0)
  6. Thermal equilibrium: As t → ∞, Tf → Tm → T_inj (behind the front)

Transport Type Classification

Transport Governing Equation Solution Type
Hydrodynamic ∂C/∂t + v·∇C = 0 Method of characteristics
Chemical (no diffusion) ∂C/∂t + v·∇C = -kCS Logistic traveling wave
Chemical (with diffusion) ∂C/∂t + v·∇C = D∇²C - kCS Green's function convolution
Thermal ∂Tf/∂t + v·∇Tf = -γ(Tf - Tm) Bessel kernel (Eq. 47)
Matrix ∂Tm/∂t = β(Tf - Tm) Exponential convolution (Eq. 48)

Dimensionless Groups

Group Definition Physical Meaning
Retardation R (C_inj + S_0)/C_inj Front slowdown factor
Damköhler Da k·τ Reaction extent over travel time
Péclet Pe v·L/D Advection vs diffusion
β·τ (exchange rate)·(travel time) Matrix equilibration extent
γ·τ (exchange rate)·(travel time) Fluid cooling extent

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