{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6264369 0.234334 -0.3446885 ] [ -1.2744784 1.3407914 0.590595 ] [ 0.9239412 -0.7739895 -0.1339625 ] [ 1.304999 0.1004551 4.8723893 ] [ -0.3747867 0.3585954 1.2437195 ] [ 2.9736533 -1.8190742 -7.4958816 ] [ -0.9268915 0.5588878 1.2678286 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.208015831855394e-09 3.75444459351756e-10 -5.52251860708509e-10 ] [ -2.041939513017705e-09 2.148184652148148e-09 9.462375091572298e-10 ] [ 1.480317001829921e-09 -1.240067891861343e-09 -2.14631587332225e-10 ] [ 2.090838905193366e-09 1.609468139861334e-10 7.806428288211616e-09 ] [ -6.004744934739676e-10 5.745331709398836e-10 1.992658322150163e-09 ] [ 4.764317834876991e-09 -2.914478178752243e-09 -1.200972635075053e-08 ] [ -1.485043903553211e-09 8.954369741876651e-10 2.031285358836932e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.245099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.243622457081676e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0481285 2.765865 1.283188 ] [ 2.3453091 2.8065844 3.759283 ] [ 3.5776512 1.1602177 2.3822376 ] [ 4.8985618 2.9601778 3.4503159 ] [ 3.2098486 4.88416 1.1940718 ] [ 4.601373 2.9194622 0.9742234 ] [ 3.4868948 4.9221139 3.5023394 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0481285e-10 2.765865e-10 1.283188e-10 ] [ 2.3453091e-10 2.8065844e-10 3.759283e-10 ] [ 3.5776512e-10 1.1602177e-10 2.3822376e-10 ] [ 4.8985618e-10 2.9601778e-10 3.4503159e-10 ] [ 3.2098486e-10 4.88416e-10 1.1940718e-10 ] [ 4.601373e-10 2.9194622e-10 9.742234e-11 ] [ 3.4868948e-10 4.922113900000001e-10 3.5023394e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.07e-05 6.8e-06 8.6e-06 ] [ 8e-07 4.4e-06 4.2e-06 ] [ 3.6e-06 2.5e-05 -3.6e-06 ] [ -1.05e-05 2.1e-06 -0.0 ] [ 1.04e-05 -3.12e-05 1.1e-05 ] [ 2.07e-05 8.1e-06 -1.17e-05 ] [ -4.3e-06 -1.53e-05 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.316505632379999e-14 1.08948011112e-14 1.37787190524e-14 ] [ 1.2817413072e-15 7.0495771896e-15 6.729141862799999e-15 ] [ 5.767835882399999e-15 4.005441585e-14 -5.767835882399999e-15 ] [ -1.6822854657e-14 3.364570931399999e-15 0.0 ] [ 1.66626369936e-14 -4.998791098079999e-14 1.7623942974e-14 ] [ 3.316505632379999e-14 1.29776307354e-14 -1.87454666178e-14 ] [ -6.8893595262e-15 -2.45133025002e-14 -1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.152427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.549210092579071e-18 } }