{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.007849 1.586086 2.268554 ] [ 2.12772 3.766083 1.838374 ] [ 4.424479 1.287894 2.441313 ] [ 3.363204 2.429439 0.4572432 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007849e-10 1.586086e-10 2.268554e-10 ] [ 2.12772e-10 3.766083e-10 1.838374e-10 ] [ 4.424479e-10 1.287894e-10 2.441313e-10 ] [ 3.363204e-10 2.429439e-10 4.572432e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3825658 -1.5702108 1.0539082 ] [ -0.4272502 1.6914617 0.1159721 ] [ -0.416021 0.1771868 -0.5057569 ] [ 1.225837 -0.2984377 -0.6641234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.129379857275172e-10 -2.515755054214447e-09 1.688547092420999e-09 ] [ -6.845302873118268e-10 2.710020413045918e-09 1.858077888159114e-10 ] [ -6.665391254533139e-10 2.838845508132312e-10 -8.103118876642745e-10 ] [ 1.964007398492658e-09 -4.781499096447017e-10 -1.064042993572636e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.787547546151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.247702671460835e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0575809 1.6931194 2.9331821 ] [ 1.9231574 3.4491887 1.4993908 ] [ 4.0385799 1.0856863 2.0035047 ] [ 3.9039337 2.8415076 0.5694065 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0575809e-10 1.6931194e-10 2.9331821e-10 ] [ 1.9231574e-10 3.4491887e-10 1.4993908e-10 ] [ 4.0385799e-10 1.0856863e-10 2.0035047e-10 ] [ 3.9039337e-10 2.8415076e-10 5.694065000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 -4.59e-05 5.85e-05 ] [ -3.02e-05 4.74e-05 -3.04e-05 ] [ -3.3e-06 5.71e-05 -5.87e-05 ] [ 4.32e-05 -5.86e-05 3.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.55411133498e-14 -7.353990750059999e-14 9.372733308899998e-14 ] [ -4.838573434679999e-14 7.59431724516e-14 -4.870616967359999e-14 ] [ -5.2871828922e-15 9.148428580139999e-14 -9.404776841579999e-14 ] [ 6.92140305888e-14 -9.38875507524e-14 4.90266050004e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }