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Commit 67bcf653 authored by Marcin Kirsz's avatar Marcin Kirsz
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fill_T start argument

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Pipeline #37574 passed
Pipeline: Tadah.MLIP

#37578

    ......@@ -69,7 +69,7 @@ class DesignMatrix : public DesignMatrixBase {
    F f;
    phi_type Phi;
    t_type T;
    t_type Tlabels; // 0-Energy, 1-Force, 2-Stress
    t_type Tlabels; // 0-Energy, 1-Force, 2-Stress // TODO should be array of int not double
    bool scale=true; // Control escale,fscale,sscale
    double e_std_dev=1;
    ......@@ -194,8 +194,8 @@ class DesignMatrix : public DesignMatrixBase {
    f.calc_phi_stress_rows(Phi,row,sscale_arr,st,st_d);
    }
    }
    void fill_T(const StructureDB &stdb) {
    size_t j=0;
    void fill_T(const StructureDB &stdb, size_t start=0) {
    size_t j=start;
    for (size_t s=0; s<stdb.size(); ++s) {
    double escale = 1;
    ......
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