{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.8084877 9.0747734 -3.3618382 ] [ -7.0483885 -5.3153424 13.6055161 ] [ -18.4967037 -16.1563122 -5.5761232 ] [ 9.360287 -9.6833866 -19.4493601 ] [ 22.5774377 -11.9720246 4.6477461 ] [ 4.8112417 22.8680077 17.9247814 ] [ 8.6046135 11.1842848 -7.7907222 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.173669588634436e-08 1.453938978053773e-08 -5.386258566952354e-09 ] [ -1.129276326901558e-08 -8.516117324826962e-09 2.179843980933799e-08 ] [ -2.963498623000486e-08 -2.588526568518581e-08 -8.93393422574048e-09 ] [ 1.499683299537817e-08 -1.5514495620688e-08 -3.116131004174035e-08 ] [ 3.617304284050853e-08 -1.918129791776247e-08 7.44651014083438e-09 ] [ 7.708458968758048e-09 3.663858730121438e-08 2.87186656920307e-08 ] [ 1.378611058072006e-08 1.791919962692881e-08 -1.248211296798754e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 8.5757063 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.373979614070727e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.952805 2.3931411 3.5478967 ] [ 3.8082697 1.5690019 5.8216404 ] [ 1.7032168 0.7549254 2.0118321 ] [ 4.0607262 0.8607436 2.1686773 ] [ 4.5587656 -0.06911 4.285499 ] [ 2.947629 3.2906209 4.4472456 ] [ 4.3956947 3.1640796 2.5828018 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.528050000000001e-11 2.3931411e-10 3.5478967e-10 ] [ 3.8082697e-10 1.5690019e-10 5.8216404e-10 ] [ 1.7032168e-10 7.549254e-11 2.0118321e-10 ] [ 4.060726200000001e-10 8.607436e-11 2.1686773e-10 ] [ 4.5587656e-10 -6.911000000000001e-12 4.285499e-10 ] [ 2.947629e-10 3.2906209e-10 4.4472456e-10 ] [ 4.3956947e-10 3.1640796e-10 2.5828018e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 -1.89e-05 5.79e-05 ] [ 1.42e-05 4.3e-06 -1.08e-05 ] [ 6e-05 1.21e-05 -2.81e-05 ] [ -3.46e-05 -3.2e-05 -2.12e-05 ] [ -4.94e-05 1.48e-05 2.9e-05 ] [ -2.49e-05 -1.74e-05 -1.5e-06 ] [ 3.38e-05 3.71e-05 -2.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-15 -3.028113813312e-14 9.276602634432e-14 ] [ 2.275090801536e-14 6.889359469440001e-15 -1.730350750464e-14 ] [ 9.6130597248e-14 1.938633711168e-14 -4.502116304448e-14 ] [ -5.543531107968001e-14 -5.12696518656e-14 -3.396614436096001e-14 ] [ -7.914752506752001e-14 2.371221398784e-14 4.64631220032e-14 ] [ -3.989419785791999e-14 -2.787787320192e-14 -2.4032649312e-15 ] [ 5.415356978304e-14 5.944075263168e-14 -4.08555038304e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }