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  <command_line><![CDATA[ at_file=./train.xyz gap={distance_Nb order=2 compact_clusters=T cutoff=5.92 n_sparse=65 cutoff_transition_width=1.0 sparse_method=uniform delta=2.74 covariance_type=ard_se theta_uniform=1.0 add_species : soap cutoff=5.92 n_sparse=1200 covariance_type=dot_product sparse_method=cur_points delta=0.78 zeta=4 l_max=4 n_max=8 atom_sigma=0.5 cutoff_transition_width=1.0 add_species} gp_file=gap_LiKCl.xml default_sigma={0.002 0.1 0.2 0.0} config_type_sigma={melt:0.005:0.1:0.2:0.0:wetmd:0.005:0.1:0.2:0.0:isolated_atom:0.0001:0.01:1.0:0.0} sparse_jitter=1.0e-8 energy_parameter_name=energy force_parameter_name=forces virial_parameter_name=stress do_copy_at_file=F]]></command_line>
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</GAP_2021_9_27_0_1_17_37_618>
