{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1214317 -2.6011675 0.2252288 ] [ -0.8599622 2.519229 -4.0409579 ] [ -3.3622635 -1.0017051 1.9658187 ] [ 0.4369643 -0.8906777 -0.5170581 ] [ 0.1220693 -1.3676942 -1.3552533 ] [ 2.5458049 3.4404417 0.6453654 ] [ 2.238819 -0.0984262 3.0768565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.796731666366898e-09 -4.167529789620195e-09 3.608563206638592e-10 ] [ -1.377811342963235e-09 4.036249839495186e-09 -6.474328326357708e-09 ] [ -5.386940017051059e-09 -1.604908505378633e-09 3.149588787820256e-09 ] [ 7.000939913521662e-10 -1.427022999364862e-09 -8.284184062404352e-10 ] [ 1.955765801887362e-10 -2.191287689697323e-09 -2.171355170411392e-09 ] [ 4.078829125502706e-09 5.512195302379237e-09 1.033989364272064e-09 ] [ 3.586983489555245e-09 -1.576961578134108e-10 4.929667590471021e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.769638 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.366356889623849e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2928035 2.3478908 2.089521 ] [ 2.8627586 4.3722625 0.9340812 ] [ 2.396117 3.852515 4.02883 ] [ 5.9293295 3.1285742 1.6918523 ] [ 4.4836886 1.4593683 2.6309231 ] [ 4.4692015 4.7891236 2.7216734 ] [ 4.6321522 2.9456517 4.5814149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2928035e-10 2.3478908e-10 2.089521e-10 ] [ 2.8627586e-10 4.3722625e-10 9.340812e-11 ] [ 2.396117e-10 3.852515e-10 4.02883e-10 ] [ 5.929329499999999e-10 3.1285742e-10 1.6918523e-10 ] [ 4.4836886e-10 1.4593683e-10 2.6309231e-10 ] [ 4.4692015e-10 4.7891236e-10 2.7216734e-10 ] [ 4.6321522e-10 2.9456517e-10 4.581414900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.34e-05 -4.2e-06 -1.72e-05 ] [ -2.09e-05 1.34e-05 -1.1e-06 ] [ 8.2e-06 -4e-07 3e-05 ] [ -1.49e-05 -9.6e-06 4.27e-05 ] [ -7.9e-06 1.25e-05 -1.3e-05 ] [ 5.1e-06 -1.98e-05 -3.31e-05 ] [ -2.9e-06 8.1e-06 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.351269957559999e-14 -6.729141862799999e-15 -2.75574381048e-14 ] [ -3.34854916506e-14 2.14691668956e-14 -1.7623942974e-15 ] [ 1.31378483988e-14 -6.408706536e-16 4.806529901999999e-14 ] [ -2.38724318466e-14 -1.53808956864e-14 6.84129422718e-14 ] [ -1.26571954086e-14 2.0027207925e-14 -2.082829624199999e-14 ] [ 8.1711008334e-15 -3.17230973532e-14 -5.303204658539999e-14 ] [ -4.6463122386e-15 1.29776307354e-14 -1.34582837256e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.392252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.786545976703976e-18 } }