{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9066893 0.9379891 0.1369545 ] [ 0.7550462 2.78121 2.963246 ] [ 2.797941 0.0158314 0.1688765 ] [ 2.09203 0.1495358 1.796908 ] [ 2.487588 2.015226 1.460751 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.066893000000001e-11 9.379891e-11 1.369545e-11 ] [ 7.550462e-11 2.78121e-10 2.963246e-10 ] [ 2.797941e-10 1.58314e-12 1.688765e-11 ] [ 2.09203e-10 1.495358e-11 1.796908e-10 ] [ 2.487588e-10 2.015226e-10 1.460751e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 26.1950258 162.1589482 -185.7167948 ] [ -58.4562002 32.5750556 52.2018106 ] [ -23.9910572 -7.2994616 -215.704839 ] [ 102.1367117 -251.4859817 488.9108627 ] [ -45.8844801 64.0514395 -139.6910395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.196905826378716e-08 2.598072778000563e-07 -2.975511091699327e-07 ] [ -9.365715807286611e-08 5.219099293357084e-08 8.363652119581352e-08 ] [ -3.843791127079746e-08 -1.169502681630025e-08 -3.455972528865319e-07 ] [ 1.636410529593344e-07 -4.029249636582916e-07 7.83321560326722e-07 ] [ -7.351504187945797e-08 1.026217197409646e-07 -2.23809719466071e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 164.81258 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.640588646652557e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.530938 0.7310697 -0.6969747 ] [ 1.4605691 2.6386444 3.8516709 ] [ 3.5044056 -0.146933 0.2050312 ] [ 1.1445006 -0.0540246 2.2956864 ] [ 2.3988812 2.7310357 0.8713222 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.30938e-11 7.310697e-11 -6.969747e-11 ] [ 1.4605691e-10 2.6386444e-10 3.8516709e-10 ] [ 3.5044056e-10 -1.46933e-11 2.050312e-11 ] [ 1.1445006e-10 -5.40246e-12 2.2956864e-10 ] [ 2.3988812e-10 2.7310357e-10 8.713222e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.13e-05 -1.74e-05 -7.4e-06 ] [ 2.09e-05 -1.92e-05 -6.6e-06 ] [ 2.93e-05 1.07e-05 1.07e-05 ] [ -2.48e-05 2.93e-05 -7.2e-06 ] [ -4e-06 -3.4e-06 1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.41263623042e-14 -2.78778734316e-14 -1.18561070916e-14 ] [ 3.34854916506e-14 -3.076179137279999e-14 -1.05743657844e-14 ] [ 4.69437753762e-14 1.71432899838e-14 1.71432899838e-14 ] [ -3.97339805232e-14 4.69437753762e-14 -1.15356717648e-14 ] [ -6.408706535999999e-15 -5.4474005556e-15 1.69830723204e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.138168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.784531251516651e-18 } }