{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -53.8793618 -68.6438116 -30.3166373 ] [ 21.4699488 -28.5263277 11.1647351 ] [ -13.9295042 21.834299 -4.3414249 ] [ -24.6043163 28.9844671 7.2170144 ] [ 3.4507278 -5.2330875 1.1505833 ] [ 67.4925057 51.5844607 15.1257294 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.632425453079217e-08 -1.099795110142182e-07 -4.857260790351284e-08 ] [ 3.439865030053634e-08 -4.570421569476696e-08 1.788787770201965e-08 ] [ -2.231752615244486e-08 3.498240367756956e-08 -6.955729533045785e-09 ] [ -3.942046067140533e-08 4.643823593656174e-08 1.156293183892153e-08 ] [ 5.528675451454225e-09 -8.384330516177474e-09 1.843437678730612e-09 ] [ 1.081349156026518e-07 8.264741761103127e-08 2.423409021688684e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.7250617 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.968206815948317e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6979277 2.2414119 2.1389201 ] [ 2.6400467 1.3058656 4.4167046 ] [ 1.957695 4.9114356 2.7305391 ] [ 1.0103323 3.3324235 4.5645011 ] [ 4.9232689 2.2086749 3.776763 ] [ 3.9759144 3.5324806 1.8305462 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6979277e-10 2.2414119e-10 2.1389201e-10 ] [ 2.6400467e-10 1.3058656e-10 4.4167046e-10 ] [ 1.957695e-10 4.9114356e-10 2.7305391e-10 ] [ 1.0103323e-10 3.3324235e-10 4.5645011e-10 ] [ 4.9232689e-10 2.2086749e-10 3.776763e-10 ] [ 3.9759144e-10 3.5324806e-10 1.8305462e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.17e-05 8.34e-05 5.27e-05 ] [ -5.09e-05 -5.9e-06 1.88e-05 ] [ -3.03e-05 9e-07 -1.33e-05 ] [ 3.06e-05 -5.22e-05 -4.16e-05 ] [ 3.47e-05 8e-06 -3.1e-06 ] [ -1.58e-05 -3.42e-05 -1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.078899929779999e-14 1.336215312756e-13 8.44347086118e-14 ] [ -8.155079067059998e-14 -9.452842140600001e-15 3.012092071919999e-14 ] [ -4.854595201019999e-14 1.4419589706e-15 -2.13089492322e-14 ] [ 4.90266050004e-14 -8.36336202948e-14 -6.665054797439999e-14 ] [ 5.55955291998e-14 1.2817413072e-14 -4.9667475654e-15 ] [ -2.53143908172e-14 -5.479444088279999e-14 -2.162938455899999e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.426274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.272649892248171e-18 } }