{ "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" [ [ 2.180035 1.415878 2.755479 ] [ 0.3300308 2.592052 2.653614 ] [ 2.100058 3.620481 1.423788 ] [ 2.171562 4.236408 3.751897 ] [ 3.719666 3.140383 2.648489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.180035e-10 1.415878e-10 2.755479e-10 ] [ 3.300308e-11 2.592052e-10 2.653614e-10 ] [ 2.100058e-10 3.620481e-10 1.423788e-10 ] [ 2.171562e-10 4.236408e-10 3.751897e-10 ] [ 3.719666e-10 3.140383e-10 2.648489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 46.5011789 -49.6719554 13.0736613 ] [ 46.5456348 139.1743674 178.000342 ] [ 27.1812806 66.5790827 -244.5488472 ] [ -259.8485415 -81.1580605 56.4449313 ] [ 139.6204472 -74.9234342 -2.9700873 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.450310167321826e-08 -7.958324565130032e-08 2.094631448311773e-08 ] [ 7.457432787685488e-08 2.229819176629097e-07 2.851879864468043e-07 ] [ 4.35492123007246e-08 1.066714497362497e-07 -3.918104456274315e-07 ] [ -4.163232581402786e-07 -1.30029547122572e-07 9.043474929152214e-08 ] [ 2.236966162894808e-07 -1.200405746252872e-07 -4.758604433794996e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 43.183131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.918700290114373e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3032912 0.9203816 2.956834 ] [ 0.1103667 2.8109618 2.6740595 ] [ 1.9995986 3.7715798 0.6812773 ] [ 1.9979215 4.3111584 4.3018485 ] [ 4.0901739 3.1911203 2.6192478 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3032912e-10 9.203816000000001e-11 2.956834e-10 ] [ 1.103667e-11 2.8109618e-10 2.6740595e-10 ] [ 1.9995986e-10 3.7715798e-10 6.812773e-11 ] [ 1.9979215e-10 4.3111584e-10 4.301848500000001e-10 ] [ 4.0901739e-10 3.1911203e-10 2.6192478e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.2e-06 -2.9e-06 -1.6e-06 ] [ -9.3e-06 -1.26e-05 -5.7e-06 ] [ 2.9e-06 1e-06 -7.4e-06 ] [ -1e-06 1.9e-05 2.4e-05 ] [ 1.17e-05 -4.4e-06 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.72914180736e-15 -4.646312200320001e-15 -2.56348259328e-15 ] [ -1.490024257344e-14 -2.018742542208e-14 -9.13240673856e-15 ] [ 4.646312200320001e-15 1.6021766208e-15 -1.185610699392e-14 ] [ -1.6021766208e-15 3.04413557952e-14 3.84522388992e-14 ] [ 1.874546646336e-14 -7.04957713152e-15 -1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }