{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6416981 -5.297495 0.5935087 ] [ -1.8790412 1.0656107 -1.231409 ] [ -0.9115108 0.2991514 1.6342971 ] [ 3.3088547 4.3282046 -1.0091196 ] [ 0.518654 -1.4568578 0.6623349 ] [ -0.275053 0.7385427 -0.1881561 ] [ 0.8797943 0.3228432 -0.461456 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.63029031423178e-09 -8.487522637804895e-09 9.50905763381401e-10 ] [ -3.010555880159977e-09 1.707296550414323e-09 -1.972934710442707e-09 ] [ -1.460401293366705e-09 4.792933791595891e-10 2.618432605061239e-09 ] [ 5.301369641964198e-09 6.934548220159016e-09 -1.616787830711048e-09 ] [ 8.309753130844031e-10 -2.334143506990122e-09 1.061177491919906e-09 ] [ -4.406834860809024e-10 1.183275847402508e-09 -3.014593044809069e-10 ] [ 1.409585858573102e-09 5.172518272242586e-10 -7.393340147278847e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.234397 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.799948822218566e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.564702 0.2474636 2.788002 ] [ 1.4946962 2.2578848 2.6296776 ] [ 1.7986608 2.6483376 4.8738733 ] [ 3.5417378 3.147992 2.1510361 ] [ 2.8806314 0.6533321 5.120961 ] [ 4.6412204 1.3957546 3.5302485 ] [ 3.8576994 3.5539222 4.4839767 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.564702e-10 2.474636e-11 2.788002e-10 ] [ 1.4946962e-10 2.2578848e-10 2.6296776e-10 ] [ 1.7986608e-10 2.6483376e-10 4.8738733e-10 ] [ 3.5417378e-10 3.147992e-10 2.1510361e-10 ] [ 2.8806314e-10 6.533321e-11 5.120961e-10 ] [ 4.6412204e-10 1.3957546e-10 3.5302485e-10 ] [ 3.8576994e-10 3.5539222e-10 4.4839767e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -2.84e-05 2.4e-05 ] [ 2.8e-06 -2.1e-06 6e-06 ] [ -4.33e-05 -8.6e-06 7.6e-06 ] [ 1.63e-05 4.23e-05 -3.82e-05 ] [ -1.7e-06 -1.32e-05 -2.7e-06 ] [ -6e-07 -4.58e-05 -2.61e-05 ] [ 2.28e-05 5.6e-05 2.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.76783583488e-15 -4.550181603071999e-14 3.84522388992e-14 ] [ 4.48609453824e-15 -3.36457090368e-15 9.6130597248e-15 ] [ -6.937424768064e-14 -1.377871893888e-14 1.217654231808e-14 ] [ 2.611547891904e-14 6.777207105984e-14 -6.120314691456e-14 ] [ -2.72370025536e-15 -2.114873139456e-14 -4.32587687616e-15 ] [ -9.6130597248e-16 -7.337968923264e-14 -4.181680980288e-14 ] [ 3.652962695424e-14 8.97218907648e-14 4.694377498944e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }