♻️ further refactoring step fixing
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		| @@ -91,14 +91,14 @@ __global__ void calc_force( | ||||
|     atom_fz(i) = fiz; | ||||
| } | ||||
|  | ||||
| __global__ void kernel_initial_integrate(MD_FLOAT dtforce, MD_FLOAT dt, int Nlocal, Atom a) { | ||||
| __global__ void kernel_initial_integrate(MD_FLOAT dtforce, MD_FLOAT dt, int Nlocal, Atom *a) { | ||||
|  | ||||
|     const int i = blockIdx.x * blockDim.x + threadIdx.x; | ||||
|     if( i >= Nlocal ) { | ||||
|         return; | ||||
|     } | ||||
|  | ||||
|     Atom *atom = &a; | ||||
|     Atom *atom = a; | ||||
|  | ||||
|     atom_vx(i) += dtforce * atom_fx(i); | ||||
|     atom_vy(i) += dtforce * atom_fy(i); | ||||
| @@ -108,14 +108,14 @@ __global__ void kernel_initial_integrate(MD_FLOAT dtforce, MD_FLOAT dt, int Nloc | ||||
|     atom_z(i) = atom_z(i) + dt * atom_vz(i); | ||||
| } | ||||
|  | ||||
| __global__ void kernel_final_integrate(MD_FLOAT dtforce, int Nlocal, Atom a) { | ||||
| __global__ void kernel_final_integrate(MD_FLOAT dtforce, int Nlocal, Atom *a) { | ||||
|  | ||||
|     const int i = blockIdx.x * blockDim.x + threadIdx.x; | ||||
|     if( i >= Nlocal ) { | ||||
|         return; | ||||
|     } | ||||
|  | ||||
|     Atom *atom = &a; | ||||
|     Atom *atom = a; | ||||
|  | ||||
|     atom_vx(i) += dtforce * atom_fx(i); | ||||
|     atom_vy(i) += dtforce * atom_fy(i); | ||||
|   | ||||
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