{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2869528 0.4871961 1.041667 ] [ 1.49337 1.111154 0.3370846 ] [ 0.208303 2.963803 0.6319363 ] [ 0.9157171 2.598087 2.560793 ] [ 2.236963 2.266905 1.430037 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.869528e-11 4.871961e-11 1.041667e-10 ] [ 1.49337e-10 1.111154e-10 3.370846e-11 ] [ 2.08303e-11 2.963803e-10 6.319363e-11 ] [ 9.157170999999999e-11 2.598087e-10 2.560793e-10 ] [ 2.236963e-10 2.266905e-10 1.430037e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -44.9024559 -27.0300458 23.1454109 ] [ 36.4030053 3.3554933 -39.9616999 ] [ -11.1100837 8.3179804 -8.1858813 ] [ -16.932858 6.6977328 25.5938532 ] [ 36.5423923 8.6588393 -0.5916828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.194166505948302e-08 -4.330690743991323e-08 3.708303622278948e-08 ] [ 5.832404401851849e-08 5.376092916511041e-09 -6.40257013072057e-08 ] [ -1.780031635927116e-08 1.332687372915263e-08 -1.311522763950391e-08 ] [ -2.712942921092625e-08 1.073095090452532e-08 4.100587323322727e-08 ] [ 5.854736661116194e-08 1.387298988972424e-08 -9.479803490894822e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 21.463619 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.438850855955868e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0991792 0.6608668 1.166386 ] [ 2.0019566 0.773905 -0.0060511 ] [ -0.3698214 3.1242315 0.5947747 ] [ 0.7785008 2.4276506 2.7544745 ] [ 2.8298491 2.4404911 1.4919338 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.91792e-12 6.608668e-11 1.166386e-10 ] [ 2.0019566e-10 7.73905e-11 -6.0511e-13 ] [ -3.698214000000001e-11 3.1242315e-10 5.947747e-11 ] [ 7.785008e-11 2.4276506e-10 2.7544745e-10 ] [ 2.8298491e-10 2.4404911e-10 1.4919338e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-06 6.5e-06 2.64e-05 ] [ 3.9e-06 5.16e-05 6e-06 ] [ 3.01e-05 -2.78e-05 1.61e-05 ] [ 8.7e-06 7.4e-06 -5.43e-05 ] [ -4.39e-05 -3.78e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.92261194496e-15 1.04141480352e-14 4.229746278912e-14 ] [ 6.24848882112e-15 8.267231363328e-14 9.6130597248e-15 ] [ 4.822551628608e-14 -4.454051005824e-14 2.579504359488e-14 ] [ 1.393893660096e-14 1.185610699392e-14 -8.699819050944e-14 ] [ -7.033555365312e-14 -6.056227626623999e-14 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.013682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.764586380932578e-18 } }