{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5878697 -1.3457888 -1.5044381 ] [ -3.0223613 -12.3489378 9.8728898 ] [ -9.3151819 1.2417163 -4.4756079 ] [ -0.0511515 -1.775409 -9.9242134 ] [ 1.948894 0.4878611 9.7229192 ] [ 5.4881841 7.7590271 -11.2185335 ] [ 5.5394864 5.9815312 7.5269839 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.4187108941671e-10 -2.156191351894487e-09 -2.410375551260772e-09 ] [ -4.842356614470695e-09 -1.978517943487338e-08 1.581811321729479e-08 ] [ -1.492456665867933e-08 1.989448825526279e-09 -7.170714341247785e-09 ] [ -8.19537374188512e-11 -2.844518792157907e-09 -1.590034268931008e-08 ] [ 3.122472403217395e-09 7.816396486177709e-10 1.557783382816744e-08 ] [ 8.793040255666288e-09 1.243133181977362e-08 -1.79740720933616e-08 ] [ 8.875235601319557e-09 9.583469445225769e-09 1.205955762971801e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.19475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.59468498297008e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7751142 2.0422195 1.608309 ] [ 2.8497716 2.5652999 3.9778698 ] [ 1.9918779 4.2326924 2.3028392 ] [ 4.9512306 2.8764818 1.3242052 ] [ 5.236378 2.8712893 3.6546255 ] [ 4.1082107 5.0639921 1.4519115 ] [ 3.8635019 4.863145 3.8589397 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7751142e-10 2.0422195e-10 1.608309e-10 ] [ 2.8497716e-10 2.5652999e-10 3.9778698e-10 ] [ 1.9918779e-10 4.232692400000001e-10 2.3028392e-10 ] [ 4.9512306e-10 2.8764818e-10 1.3242052e-10 ] [ 5.236378000000001e-10 2.8712893e-10 3.6546255e-10 ] [ 4.1082107e-10 5.0639921e-10 1.4519115e-10 ] [ 3.8635019e-10 4.863145e-10 3.8589397e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.28e-05 -2.09e-05 -3.31e-05 ] [ -2.9e-06 -1.4e-06 -1.15e-05 ] [ -1.61e-05 6e-07 1.8e-05 ] [ -6.3e-06 6e-07 2.78e-05 ] [ 2.49e-05 1.27e-05 2.4e-05 ] [ 6.7e-06 1.74e-05 -2.6e-05 ] [ 1.65e-05 -8.9e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.652962695424e-14 -3.348549137472e-14 -5.303204614848e-14 ] [ -4.646312200320001e-15 -2.24304726912e-15 -1.84250311392e-14 ] [ -2.579504359488e-14 9.6130597248e-16 2.88391791744e-14 ] [ -1.009371271104e-14 9.6130597248e-16 4.454051005824e-14 ] [ 3.989419785791999e-14 2.034764308416e-14 3.84522388992e-14 ] [ 1.073458335936e-14 2.787787320192e-14 -4.16565921408e-14 ] [ 2.64359142432e-14 -1.425937192512e-14 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.526286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.609108878265435e-18 } }