mirror of https://github.com/lammps/lammps.git
remove unused setting and array
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10c0b8d90e
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@ -58,7 +58,7 @@ void PairUFMOpt::eval()
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typedef struct { double x,y,z; } vec3_t;
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typedef struct {
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double cutsq,uf1,uf2,uf3,uf4,scale,offset;
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double cutsq,uf1,uf2,uf3,scale,offset;
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double _pad[2];
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} fast_alpha_t;
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@ -91,7 +91,6 @@ void PairUFMOpt::eval()
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a.uf1 = uf1[i+1][j+1];
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a.uf2 = uf2[i+1][j+1];
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a.uf3 = uf3[i+1][j+1];
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a.uf4 = uf4[i+1][j+1];
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a.scale = scale[i+1][j+1];
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a.offset = offset[i+1][j+1];
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}
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@ -53,7 +53,6 @@ PairUFM::~PairUFM()
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memory->destroy(uf1);
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memory->destroy(uf2);
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memory->destroy(uf3);
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memory->destroy(uf4);
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memory->destroy(offset);
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}
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}
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@ -154,7 +153,6 @@ void PairUFM::allocate()
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memory->create(uf1,n+1,n+1,"pair:uf1");
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memory->create(uf2,n+1,n+1,"pair:uf2");
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memory->create(uf3,n+1,n+1,"pair:uf3");
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memory->create(uf4,n+1,n+1,"pair:uf4");
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memory->create(offset,n+1,n+1,"pair:offset");
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}
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@ -230,7 +228,6 @@ double PairUFM::init_one(int i, int j)
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uf1[i][j] = 2.0 * epsilon[i][j] / pow(sigma[i][j],2.0);
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uf2[i][j] = 1.0 / pow(sigma[i][j],2.0);
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uf3[i][j] = epsilon[i][j];
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uf4[i][j] = sigma[i][j];
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if (offset_flag) {
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double ratio = pow(cut[i][j] / sigma[i][j],2.0);
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@ -240,7 +237,6 @@ double PairUFM::init_one(int i, int j)
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uf1[j][i] = uf1[i][j];
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uf2[j][i] = uf2[i][j];
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uf3[j][i] = uf3[i][j];
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uf4[j][i] = uf4[i][j];
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scale[j][i] = scale[i][j];
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offset[j][i] = offset[i][j];
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@ -51,7 +51,7 @@ class PairUFM : public Pair {
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double cut_global;
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double **cut,**scale;
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double **epsilon,**sigma;
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double **uf1,**uf2,**uf3,**uf4,**offset;
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double **uf1,**uf2,**uf3,**offset;
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virtual void allocate();
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};
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