{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3752204 -2.0355302 -0.566311 ] [ -0.2390457 -0.0867552 -1.390566 ] [ -1.9535091 0.946838 0.7078709 ] [ -2.0873319 -1.115194 0.8496975 ] [ 0.6284416 1.4597615 -0.6259291 ] [ 0.9613999 1.9513977 -1.3047826 ] [ 1.3148247 -1.1205177 2.3300202 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.203345973327224e-09 -3.261278897372348e-09 -9.073302443018688e-10 ] [ -3.829934318427705e-10 -1.389971531728282e-10 -2.227932334879373e-09 ] [ -3.129866608540049e-09 1.51700170728503e-09 1.134134206524655e-09 ] [ -3.344274370030044e-09 -1.786737754456435e-09 1.361365469252208e-09 ] [ 1.006874439058145e-09 2.338795747243939e-09 -1.002848970298385e-09 ] [ 1.540332443019458e-09 3.126483772822892e-09 -2.090492176946638e-09 ] [ 2.106581394790374e-09 -1.795267262132588e-09 3.73310389043174e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.971717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.641780764183392e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8068233 1.7647211 1.2564841 ] [ 2.1316368 1.1131758 3.4606192 ] [ 1.9030644 3.3325702 2.7290792 ] [ 3.8725176 -0.0278061 2.3279041 ] [ 4.9661942 2.064488 2.1688339 ] [ 4.3441887 1.1597633 4.2904542 ] [ 3.9421659 3.3803625 3.8144883 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8068233e-10 1.7647211e-10 1.2564841e-10 ] [ 2.1316368e-10 1.1131758e-10 3.4606192e-10 ] [ 1.9030644e-10 3.3325702e-10 2.7290792e-10 ] [ 3.8725176e-10 -2.78061e-12 2.3279041e-10 ] [ 4.966194200000001e-10 2.064488e-10 2.1688339e-10 ] [ 4.3441887e-10 1.1597633e-10 4.290454200000001e-10 ] [ 3.9421659e-10 3.3803625e-10 3.8144883e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.8e-06 -3.25e-05 1.57e-05 ] [ -3.99e-05 -2.79e-05 -1.05e-05 ] [ -8.4e-06 -3.1e-06 2.47e-05 ] [ 1.46e-05 8e-07 -1.41e-05 ] [ -6e-07 2.61e-05 1.99e-05 ] [ -4.32e-05 1.58e-05 -1.84e-05 ] [ 7.07e-05 2.09e-05 -1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.089480102144e-14 -5.207074017599999e-14 2.515417294656e-14 ] [ -6.392684716992e-14 -4.470072772032e-14 -1.68228545184e-14 ] [ -1.345828361472e-14 -4.96674752448e-15 3.957376253376001e-14 ] [ 2.339177866368e-14 1.28174129664e-15 -2.259069035328e-14 ] [ -9.6130597248e-16 4.181680980288e-14 3.188331475392e-14 ] [ -6.921403001856e-14 2.531439060864e-14 -2.948004982272e-14 ] [ 1.1327388709056e-13 3.348549137472e-14 -2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.337723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.860639051890644e-18 } }