{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.3361285 -0.3537355 -1.9837077 ] [ 1.4715732 -0.002197 -0.0928514 ] [ -1.1501544 1.0440565 -0.1780001 ] [ 4.4751032 -6.6811522 -5.6628643 ] [ -2.756411 -3.1605712 5.1054197 ] [ -1.4802919 4.6052118 -2.5746401 ] [ 3.7763093 4.5483876 5.3866439 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.947243707484573e-09 -5.667467480469984e-10 -3.17825009944094e-09 ] [ 2.357720176835842e-09 -3.5199820358976e-12 -1.487643422885491e-10 ] [ -1.842750489990251e-09 1.672762915094275e-09 -2.851875987200621e-10 ] [ 7.169905722707268e-09 -1.070438585484649e-08 -9.072908788222957e-09 ] [ -4.41625726151595e-09 -5.063793285013801e-09 8.17978408271175e-09 ] [ -2.371689074139612e-09 7.378362679792286e-09 -4.125028175194174e-09 ] [ 6.050314473369613e-09 7.287320275056621e-09 8.630354921154933e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.908004 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907872560919288e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0744512 3.0336747 1.9555397 ] [ 0.2866195 2.6745293 0.5495603 ] [ 2.7097285 4.2672408 4.0949236 ] [ 4.4517745 2.2261989 2.4011361 ] [ 4.1357505 2.316862 4.9393379 ] [ 3.9573201 4.8051938 1.7573386 ] [ 5.4008768 4.3019535 3.8484378 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0744512e-10 3.0336747e-10 1.9555397e-10 ] [ 2.866195e-11 2.6745293e-10 5.495603e-11 ] [ 2.7097285e-10 4.2672408e-10 4.094923600000001e-10 ] [ 4.4517745e-10 2.2261989e-10 2.4011361e-10 ] [ 4.135750500000001e-10 2.316862e-10 4.9393379e-10 ] [ 3.9573201e-10 4.805193799999999e-10 1.7573386e-10 ] [ 5.4008768e-10 4.3019535e-10 3.8484378e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 7.5e-06 -1.5e-05 ] [ -4.4e-06 -1.55e-05 1.26e-05 ] [ 1.45e-05 -1.19e-05 8.9e-06 ] [ -7.7e-06 -2.2e-05 2.04e-05 ] [ -2.7e-06 8e-06 -1.83e-05 ] [ 3.9e-05 3.56e-05 1.62e-05 ] [ -4.02e-05 -1.7e-06 -2.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 1.2016324656e-14 -2.4032649312e-14 ] [ -7.04957713152e-15 -2.48337376224e-14 2.018742542208e-14 ] [ 2.32315610016e-14 -1.906590178752e-14 1.425937192512e-14 ] [ -1.233675998016e-14 -3.52478856576e-14 3.268440306432e-14 ] [ -4.32587687616e-15 1.28174129664e-14 -2.931983216064e-14 ] [ 6.248488821120001e-14 5.703748770048e-14 2.595526125696e-14 ] [ -6.440750015616e-14 -2.72370025536e-15 -3.973398019584e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.805309 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.532289656431983e-18 } }