{ "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" [ [ -3.4519175 0.4715215 -0.245251 ] [ 1.8650122 0.0735416 -0.0457617 ] [ 0.5917976 -0.5177794 -1.2020711 ] [ 3.1393245 -5.0944896 -3.9584758 ] [ -2.4753495 -1.213702 3.1702498 ] [ -1.4569651 2.8876021 -0.9273881 ] [ 1.7880979 3.3933059 3.2086978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.530581515430384e-09 7.554607235045472e-10 -3.929354184278208e-10 ] [ 2.988078944346774e-09 1.178266321762253e-10 -7.331832586806336e-11 ] [ 9.481642789655503e-10 -8.295740494118515e-10 -1.925930212959339e-09 ] [ 5.029752319004649e-09 -8.162272132028744e-09 -6.342177380762577e-09 ] [ -3.96594709720897e-09 -1.944564969018202e-09 5.079300111655876e-09 ] [ -2.334315420541534e-09 4.626448574792984e-09 -1.485839532228133e-09 ] [ 2.864848651081576e-09 5.436675380202703e-09 5.140900598372394e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.396514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.787228801421989e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1164003 3.1083252 0.9891279 ] [ 1.040523 2.9536867 1.9770469 ] [ 1.9180994 4.0219219 3.820378 ] [ 4.5172052 1.9193007 2.3947611 ] [ 3.6019394 2.6171397 4.5573239 ] [ 3.5256952 5.0128247 2.3644209 ] [ 5.2966588 3.9924542 3.4432152 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1164003e-10 3.1083252e-10 9.891278999999999e-11 ] [ 1.040523e-10 2.9536867e-10 1.9770469e-10 ] [ 1.9180994e-10 4.0219219e-10 3.820378e-10 ] [ 4.517205200000001e-10 1.9193007e-10 2.3947611e-10 ] [ 3.6019394e-10 2.6171397e-10 4.5573239e-10 ] [ 3.5256952e-10 5.012824700000001e-10 2.3644209e-10 ] [ 5.2966588e-10 3.9924542e-10 3.4432152e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.69e-05 -2.36e-05 4.55e-05 ] [ -3.05e-05 -5.35e-05 -5.24e-05 ] [ 3.21e-05 4.33e-05 7.61e-05 ] [ -2.88e-05 1.28e-05 -2.15e-05 ] [ -3e-06 -3.7e-06 -4.98e-05 ] [ 5.49e-05 3e-07 5.3e-06 ] [ -5.16e-05 2.45e-05 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.309855109952001e-14 -3.781136825088e-14 7.28990362464e-14 ] [ -4.88663869344e-14 -8.57164492128e-14 -8.395405492992e-14 ] [ 5.142986952768e-14 6.937424768064e-14 1.2192564084288e-13 ] [ -4.614268667904e-14 2.050786074624e-14 -3.44467973472e-14 ] [ -4.8065298624e-15 -5.928053496960001e-15 -7.978839571583999e-14 ] [ 8.795949648192e-14 4.8065298624e-16 8.491536090240001e-15 ] [ -8.267231363328e-14 3.92533272096e-14 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }