{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.6079 1.726733 2.75301 ] [ 2.002918 3.986459 1.396167 ] [ 4.133267 4.619556 1.499098 ] [ 3.466505 3.469363 3.287809 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6079e-10 1.726733e-10 2.75301e-10 ] [ 2.002918e-10 3.986459e-10 1.396167e-10 ] [ 4.133267e-10 4.619556e-10 1.499098e-10 ] [ 3.466505e-10 3.469363e-10 3.287809000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5524428 1.2724365 -0.4902686 ] [ -31.9790438 -3.7973764 -13.5159419 ] [ 28.1900993 17.5959067 -16.3768429 ] [ 3.2365018 -15.0709667 30.3830534 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.851109457815351e-10 2.038668028548741e-09 -7.854968953038924e-10 ] [ -5.123607675402256e-08 -6.084067738583037e-09 -2.165492629868156e-08 ] [ 4.516551840859975e-08 2.819175056878405e-08 -2.62385950330688e-08 ] [ 5.18544755985894e-09 -2.414635069853208e-08 4.867901822705426e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.31617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.517443356371779e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5006881 1.7951127 2.8228639 ] [ 1.8883949 3.8473012 1.2733415 ] [ 4.2768493 4.8611518 1.4471889 ] [ 3.5446576 3.2985453 3.3926897 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5006881e-10 1.7951127e-10 2.8228639e-10 ] [ 1.8883949e-10 3.8473012e-10 1.2733415e-10 ] [ 4.276849300000001e-10 4.8611518e-10 1.4471889e-10 ] [ 3.5446576e-10 3.2985453e-10 3.3926897e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.8e-06 -1.45e-05 1.16e-05 ] [ 2.8e-06 2.66e-05 -3.58e-05 ] [ -1.84e-05 -3.5e-06 -2.8e-06 ] [ 2.23e-05 -8.6e-06 2.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.08948011112e-14 -2.3231561193e-14 1.85852489544e-14 ] [ 4.486094575199999e-15 4.26178984644e-14 -5.735792349719999e-14 ] [ -2.94800500656e-14 -5.607618218999999e-15 -4.486094575199999e-15 ] [ 3.572853893819999e-14 -1.37787190524e-14 4.325876911799999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.675149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.030782756026846e-18 } }