{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.341275 -5.1899411 -1.8527598 ] [ -7.6889469 8.2797796 -1.5261259 ] [ -1.6233789 -5.5744853 -3.9704416 ] [ 5.4103698 -5.9991908 -4.261563 ] [ 5.0092045 -6.4112547 1.8974966 ] [ 5.543741 3.721049 0.9832882 ] [ 1.6902855 11.1740434 8.7301056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.336419590276835e-08 -8.315202362256257e-09 -2.968448459974513e-09 ] [ -1.231905106324673e-08 1.326566940978986e-08 -2.445123257522221e-09 ] [ -2.600939741708623e-09 -8.93131009423648e-09 -6.361348758181574e-09 ] [ 8.668368074859252e-09 -9.611763322667766e-09 -6.827776662918941e-09 ] [ 8.025630404827653e-09 -1.027196247496268e-08 3.040124715614444e-09 ] [ 8.882052295147793e-09 5.961777761769066e-09 1.575401378527918e-09 ] [ 2.708135932889007e-09 1.790279124278191e-08 1.398717120467255e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.187585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.632231064388889e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6333122 1.2680389 3.6797773 ] [ 1.9519643 4.8709734 2.8914013 ] [ 2.4131714 2.7035753 1.7487755 ] [ 4.780627 2.3665044 2.3485764 ] [ 3.8554256 2.0427508 4.6079101 ] [ 5.6479599 4.6679201 2.9406886 ] [ 3.7385167 4.5053282 4.5915348 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6333122e-10 1.2680389e-10 3.6797773e-10 ] [ 1.9519643e-10 4.870973399999999e-10 2.8914013e-10 ] [ 2.4131714e-10 2.7035753e-10 1.7487755e-10 ] [ 4.780627e-10 2.3665044e-10 2.3485764e-10 ] [ 3.8554256e-10 2.0427508e-10 4.6079101e-10 ] [ 5.6479599e-10 4.6679201e-10 2.9406886e-10 ] [ 3.7385167e-10 4.5053282e-10 4.5915348e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.17e-05 1.09e-05 -1.04e-05 ] [ -8.1e-06 -1.37e-05 6.9e-06 ] [ -1.48e-05 3.6e-06 1.68e-05 ] [ -1.49e-05 -6.9e-06 2.8e-06 ] [ -1.01e-05 3e-07 -2.09e-05 ] [ 1.53e-05 -2.18e-05 2e-05 ] [ -9e-06 2.76e-05 -1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.681076563779999e-14 1.74637253106e-14 -1.66626369936e-14 ] [ -1.29776307354e-14 -2.19498198858e-14 1.10550187746e-14 ] [ -2.37122141832e-14 5.767835882399999e-15 2.691656745119999e-14 ] [ -2.38724318466e-14 -1.10550187746e-14 4.486094575199999e-15 ] [ -1.61819840034e-14 4.806529901999999e-16 -3.34854916506e-14 ] [ 2.45133025002e-14 -3.492745062119999e-14 3.204353268e-14 ] [ -1.4419589706e-14 4.42200750984e-14 -2.43530848368e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735037903988e-18 } }