{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4596558 -11.1380039 13.4062703 ] [ -3.2289277 -1.4812684 0.4978248 ] [ -31.2149406 11.6430587 -9.9652913 ] [ 21.2811307 -25.8148095 -13.6946804 ] [ 10.1759909 15.7748748 -19.0531211 ] [ 7.4464025 11.0161483 28.8089977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.145156259575121e-09 -1.784504945095922e-08 2.14792128467854e-08 ] [ -5.173312471193516e-09 -2.373253599609823e-09 7.976032558144359e-10 ] [ -5.001184804898072e-08 1.865423644374204e-08 -1.596615674032164e-08 ] [ 3.409613007172914e-08 -4.135988425130574e-08 -2.194129676620799e-08 ] [ 1.630373471345355e-08 2.527413560060707e-08 -3.052646517969117e-08 ] [ 1.193045199456667e-08 1.764981525752566e-08 4.615710258362097e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.035705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.408985502824567e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0584486 1.7590073 4.947048 ] [ 0.9298349 2.1316333 3.9299352 ] [ 1.3933726 3.9581348 2.4568308 ] [ 4.4258312 1.9515178 2.8649314 ] [ 3.7151995 4.3467251 2.8599302 ] [ 3.6249809 4.1587907 5.3496145 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0584486e-10 1.7590073e-10 4.947047999999999e-10 ] [ 9.298349000000001e-11 2.1316333e-10 3.9299352e-10 ] [ 1.3933726e-10 3.9581348e-10 2.4568308e-10 ] [ 4.4258312e-10 1.9515178e-10 2.8649314e-10 ] [ 3.7151995e-10 4.3467251e-10 2.8599302e-10 ] [ 3.6249809e-10 4.1587907e-10 5.3496145e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 -6.24e-05 2.37e-05 ] [ -4.01e-05 5.3e-06 1.16e-05 ] [ 7.3e-06 -3.15e-05 -4.36e-05 ] [ -1.93e-05 2.59e-05 -2.95e-05 ] [ 2.22e-05 2.26e-05 -2.82e-05 ] [ 2.47e-05 4.01e-05 6.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 -9.997582113791999e-14 3.797158591296e-14 ] [ -6.424728249408e-14 8.491536090240001e-15 1.858524880128e-14 ] [ 1.169588933184e-14 -5.04685635552e-14 -6.985490066688e-14 ] [ -3.092200878144e-14 4.149637447872e-14 -4.72642103136e-14 ] [ 3.556832098176e-14 3.620919163008e-14 -4.518138070656001e-14 ] [ 3.957376253376001e-14 6.424728249408e-14 1.057436569728e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }