membrane starts working ok...

This commit is contained in:
James McClure
2022-04-08 16:44:37 -04:00
parent 25b17f996c
commit 2bb2be845a
7 changed files with 623 additions and 579 deletions

View File

@@ -212,7 +212,7 @@ __global__ void dvc_ScaLBL_D3Q7_Membrane_IonTransport(int *membrane, double *co
iq = membrane[2*link]; ip = membrane[2*link+1];
nq = iq%Np; np = ip%Np;
fq = dist[iq]; fp = dist[ip];
fqq = (1-aq)*fq+ap*fp; fpp = (1-ap)*fp+ap*fq;
fqq = (1-aq)*fq+ap*fp; fpp = (1-ap)*fp+aq*fq;
Cq = Den[nq]; Cp = Den[np];
Cq += fqq - fq; Cp += fpp - fp;
Den[nq] = Cq; Den[np] = Cp;
@@ -331,93 +331,96 @@ __global__ void dvc_ScaLBL_D3Q7_AAodd_Ion(int *neighborList, double *dist, doub
n = S*blockIdx.x*blockDim.x + s*blockDim.x + threadIdx.x + start;
if (n<finish) {
//Load data
Ci=Den[n];
Ex=ElectricField[n+0*Np];
Ey=ElectricField[n+1*Np];
Ez=ElectricField[n+2*Np];
ux=Velocity[n+0*Np];
uy=Velocity[n+1*Np];
uz=Velocity[n+2*Np];
uEPx=zi*Di/Vt*Ex;
uEPy=zi*Di/Vt*Ey;
uEPz=zi*Di/Vt*Ez;
//Load data
Ex = ElectricField[n + 0 * Np];
Ey = ElectricField[n + 1 * Np];
Ez = ElectricField[n + 2 * Np];
ux = Velocity[n + 0 * Np];
uy = Velocity[n + 1 * Np];
uz = Velocity[n + 2 * Np];
uEPx = zi * Di / Vt * Ex;
uEPy = zi * Di / Vt * Ey;
uEPz = zi * Di / Vt * Ez;
// q=0
f0 = dist[n];
// q=1
nr1 = neighborList[n]; // neighbor 2 ( > 10Np => odd part of dist)
f1 = dist[nr1]; // reading the f1 data into register fq
// q=2
nr2 = neighborList[n+Np]; // neighbor 1 ( < 10Np => even part of dist)
f2 = dist[nr2]; // reading the f2 data into register fq
// q=3
nr3 = neighborList[n+2*Np]; // neighbor 4
f3 = dist[nr3];
// q=4
nr4 = neighborList[n+3*Np]; // neighbor 3
f4 = dist[nr4];
// q=5
nr5 = neighborList[n+4*Np];
f5 = dist[nr5];
// q=6
nr6 = neighborList[n+5*Np];
f6 = dist[nr6];
// compute diffusive flux
flux_diffusive_x = (1.0-0.5*rlx)*((f1-f2)-ux*Ci);
flux_diffusive_y = (1.0-0.5*rlx)*((f3-f4)-uy*Ci);
flux_diffusive_z = (1.0-0.5*rlx)*((f5-f6)-uz*Ci);
FluxDiffusive[n+0*Np] = flux_diffusive_x;
FluxDiffusive[n+1*Np] = flux_diffusive_y;
FluxDiffusive[n+2*Np] = flux_diffusive_z;
FluxAdvective[n+0*Np] = ux*Ci;
FluxAdvective[n+1*Np] = uy*Ci;
FluxAdvective[n+2*Np] = uz*Ci;
FluxElectrical[n+0*Np] = uEPx*Ci;
FluxElectrical[n+1*Np] = uEPy*Ci;
FluxElectrical[n+2*Np] = uEPz*Ci;
/* use logistic function to prevent negative distributions*/
X = 4.0 * (ux + uEPx);
Y = 4.0 * (uy + uEPy);
Z = 4.0 * (uz + uEPz);
factor_x = X / sqrt(1 + X*X);
factor_y = Y / sqrt(1 + Y*Y);
factor_z = Z / sqrt(1 + Z*Z);
// q=0
f0 = dist[n];
// q=1
nr1 = neighborList[n]; // neighbor 2 ( > 10Np => odd part of dist)
f1 = dist[nr1]; // reading the f1 data into register fq
// q=2
nr2 = neighborList[n + Np]; // neighbor 1 ( < 10Np => even part of dist)
f2 = dist[nr2]; // reading the f2 data into register fq
// q=3
nr3 = neighborList[n + 2 * Np]; // neighbor 4
f3 = dist[nr3];
// q=4
nr4 = neighborList[n + 3 * Np]; // neighbor 3
f4 = dist[nr4];
// q=5
nr5 = neighborList[n + 4 * Np];
f5 = dist[nr5];
// q=6
nr6 = neighborList[n + 5 * Np];
f6 = dist[nr6];
// q=0
dist[n] = f0 * (1.0 - rlx) + rlx * 0.25 * Ci;
// compute diffusive flux
Ci = f0 + f1 + f2 + f3 + f4 + f5 + f6;
flux_diffusive_x = (1.0 - 0.5 * rlx) * ((f1 - f2) - ux * Ci);
flux_diffusive_y = (1.0 - 0.5 * rlx) * ((f3 - f4) - uy * Ci);
flux_diffusive_z = (1.0 - 0.5 * rlx) * ((f5 - f6) - uz * Ci);
FluxDiffusive[n + 0 * Np] = flux_diffusive_x;
FluxDiffusive[n + 1 * Np] = flux_diffusive_y;
FluxDiffusive[n + 2 * Np] = flux_diffusive_z;
FluxAdvective[n + 0 * Np] = ux * Ci;
FluxAdvective[n + 1 * Np] = uy * Ci;
FluxAdvective[n + 2 * Np] = uz * Ci;
FluxElectrical[n + 0 * Np] = uEPx * Ci;
FluxElectrical[n + 1 * Np] = uEPy * Ci;
FluxElectrical[n + 2 * Np] = uEPz * Ci;
Den[n] = Ci;
// q = 1
dist[nr2] =
f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_x);
//f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (ux + uEPx));
/* use logistic function to prevent negative distributions*/
X = 4.0 * (ux + uEPx);
Y = 4.0 * (uy + uEPy);
Z = 4.0 * (uz + uEPz);
factor_x = X / sqrt(1 + X*X);
factor_y = Y / sqrt(1 + Y*Y);
factor_z = Z / sqrt(1 + Z*Z);
// q=0
dist[n] = f0 * (1.0 - rlx) + rlx * 0.25 * Ci;
// q = 1
dist[nr2] =
f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_x);
//f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (ux + uEPx));
// q=2
dist[nr1] =
f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_x);
//f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (ux + uEPx));
// q=2
dist[nr1] =
f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_x);
//f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (ux + uEPx));
// q = 3
dist[nr4] =
f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_y );
//f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uy + uEPy));
// q = 3
dist[nr4] =
f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_y );
//f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uy + uEPy));
// q = 4
dist[nr3] =
f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_y);
//f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uy + uEPy));
// q = 4
dist[nr3] =
f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_y);
//f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uy + uEPy));
// q = 5
dist[nr6] =
f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_z);
//f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uz + uEPz));
// q = 5
dist[nr6] =
f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_z);
//f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uz + uEPz));
// q = 6
dist[nr5] =
f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_z);
// q = 6
dist[nr5] =
f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_z);
}
}
}
@@ -440,79 +443,82 @@ __global__ void dvc_ScaLBL_D3Q7_AAeven_Ion(double *dist, double *Den, double *F
if (n<finish) {
//Load data
Ci=Den[n];
Ex=ElectricField[n+0*Np];
Ey=ElectricField[n+1*Np];
Ez=ElectricField[n+2*Np];
ux=Velocity[n+0*Np];
uy=Velocity[n+1*Np];
uz=Velocity[n+2*Np];
uEPx=zi*Di/Vt*Ex;
uEPy=zi*Di/Vt*Ey;
uEPz=zi*Di/Vt*Ez;
//Ci = Den[n];
Ex = ElectricField[n + 0 * Np];
Ey = ElectricField[n + 1 * Np];
Ez = ElectricField[n + 2 * Np];
ux = Velocity[n + 0 * Np];
uy = Velocity[n + 1 * Np];
uz = Velocity[n + 2 * Np];
uEPx = zi * Di / Vt * Ex;
uEPy = zi * Di / Vt * Ey;
uEPz = zi * Di / Vt * Ez;
f0 = dist[n];
f1 = dist[2*Np+n];
f2 = dist[1*Np+n];
f3 = dist[4*Np+n];
f4 = dist[3*Np+n];
f5 = dist[6*Np+n];
f6 = dist[5*Np+n];
// compute diffusive flux
flux_diffusive_x = (1.0-0.5*rlx)*((f1-f2)-ux*Ci);
flux_diffusive_y = (1.0-0.5*rlx)*((f3-f4)-uy*Ci);
flux_diffusive_z = (1.0-0.5*rlx)*((f5-f6)-uz*Ci);
FluxDiffusive[n+0*Np] = flux_diffusive_x;
FluxDiffusive[n+1*Np] = flux_diffusive_y;
FluxDiffusive[n+2*Np] = flux_diffusive_z;
FluxAdvective[n+0*Np] = ux*Ci;
FluxAdvective[n+1*Np] = uy*Ci;
FluxAdvective[n+2*Np] = uz*Ci;
FluxElectrical[n+0*Np] = uEPx*Ci;
FluxElectrical[n+1*Np] = uEPy*Ci;
FluxElectrical[n+2*Np] = uEPz*Ci;
f0 = dist[n];
f1 = dist[2 * Np + n];
f2 = dist[1 * Np + n];
f3 = dist[4 * Np + n];
f4 = dist[3 * Np + n];
f5 = dist[6 * Np + n];
f6 = dist[5 * Np + n];
/* use logistic function to prevent negative distributions*/
X = 4.0 * (ux + uEPx);
Y = 4.0 * (uy + uEPy);
Z = 4.0 * (uz + uEPz);
factor_x = X / sqrt(1 + X*X);
factor_y = Y / sqrt(1 + Y*Y);
factor_z = Z / sqrt(1 + Z*Z);
// compute diffusive flux
Ci = f0 + f1 + f2 + f3 + f4 + f5 + f6;
flux_diffusive_x = (1.0 - 0.5 * rlx) * ((f1 - f2) - ux * Ci);
flux_diffusive_y = (1.0 - 0.5 * rlx) * ((f3 - f4) - uy * Ci);
flux_diffusive_z = (1.0 - 0.5 * rlx) * ((f5 - f6) - uz * Ci);
FluxDiffusive[n + 0 * Np] = flux_diffusive_x;
FluxDiffusive[n + 1 * Np] = flux_diffusive_y;
FluxDiffusive[n + 2 * Np] = flux_diffusive_z;
FluxAdvective[n + 0 * Np] = ux * Ci;
FluxAdvective[n + 1 * Np] = uy * Ci;
FluxAdvective[n + 2 * Np] = uz * Ci;
FluxElectrical[n + 0 * Np] = uEPx * Ci;
FluxElectrical[n + 1 * Np] = uEPy * Ci;
FluxElectrical[n + 2 * Np] = uEPz * Ci;
Den[n] = Ci;
/* use logistic function to prevent negative distributions*/
X = 4.0 * (ux + uEPx);
Y = 4.0 * (uy + uEPy);
Z = 4.0 * (uz + uEPz);
factor_x = X / sqrt(1 + X*X);
factor_y = Y / sqrt(1 + Y*Y);
factor_z = Z / sqrt(1 + Z*Z);
// q=0
dist[n] = f0 * (1.0 - rlx) + rlx * 0.25 * Ci;
// q=0
dist[n] = f0 * (1.0 - rlx) + rlx * 0.25 * Ci;
// q = 1
dist[1 * Np + n] =
f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_x);
//f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (ux + uEPx));
// q = 1
dist[1 * Np + n] =
f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_x);
//f1 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (ux + uEPx));
// q=2
dist[2 * Np + n] =
f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_x);
//f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (ux + uEPx));
// q=2
dist[2 * Np + n] =
f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_x);
//f2 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (ux + uEPx));
// q = 3
dist[3 * Np + n] =
f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_y);
//f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uy + uEPy));
// q = 3
dist[3 * Np + n] =
f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_y);
//f3 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uy + uEPy));
// q = 4
dist[4 * Np + n] =
f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_y);
//f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uy + uEPy));
// q = 4
dist[4 * Np + n] =
f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_y);
//f4 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uy + uEPy));
// q = 5
dist[5 * Np + n] =
f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_z);
//f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uz + uEPz));
// q = 5
dist[5 * Np + n] =
f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + factor_z);
//f5 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 + 4.0 * (uz + uEPz));
// q = 6
dist[6 * Np + n] =
f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_z);
//f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uz + uEPz));
// q = 6
dist[6 * Np + n] =
f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - factor_z);
//f6 * (1.0 - rlx) + rlx * 0.125 * Ci * (1.0 - 4.0 * (uz + uEPz));
}
}
}