{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.741553 -0.7972799 -2.2693346 ] [ -2.8697009 3.3694378 -2.1410709 ] [ -2.8029879 -2.1792334 1.501549 ] [ 2.1096205 1.0583412 1.9057953 ] [ 1.2211221 -0.063379 -0.3310334 ] [ -3.5310712 -0.613893 1.1949338 ] [ 3.1314643 -0.7739938 0.1391608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.392452121284102e-09 -1.277383216013762e-09 -3.63587484089252e-09 ] [ -4.597767690668719e-09 5.398434468399787e-09 -3.430373739455214e-09 ] [ -4.490881681765289e-09 -3.491516804746495e-09 2.405746702785619e-09 ] [ 3.379984643860407e-09 1.695649527469417e-09 3.053420673690522e-09 ] [ 1.9564532797622e-09 -1.015443520496832e-10 -5.303739741839347e-10 ] [ -5.657399723020201e-09 -9.835650122727745e-10 1.914494997763703e-09 ] [ 5.017158890329838e-09 -1.240074771004151e-09 2.229601802918247e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.398256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.229466859309333e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5580738 1.7614095 3.2705761 ] [ 1.6596868 5.4572932 2.2260714 ] [ 0.7185317 3.3288383 2.9516093 ] [ 2.6267694 3.3642073 1.4354641 ] [ 2.834555 4.1053941 3.8793619 ] [ 4.6361269 2.9211402 2.7421759 ] [ 4.080894 5.2053204 2.0966313 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5580738e-10 1.7614095e-10 3.2705761e-10 ] [ 1.6596868e-10 5.4572932e-10 2.2260714e-10 ] [ 7.185317e-11 3.3288383e-10 2.9516093e-10 ] [ 2.6267694e-10 3.3642073e-10 1.4354641e-10 ] [ 2.834555e-10 4.1053941e-10 3.8793619e-10 ] [ 4.6361269e-10 2.9211402e-10 2.7421759e-10 ] [ 4.080894e-10 5.205320399999999e-10 2.0966313e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 7.2e-06 9e-06 ] [ -1.03e-05 -1.02e-05 2.9e-06 ] [ 5.4e-06 1.72e-05 -5.3e-06 ] [ 5.7e-06 -7e-07 2.4e-06 ] [ -4.1e-06 -2.6e-06 -9.7e-06 ] [ 1.33e-05 -3.5e-06 -1.3e-05 ] [ -7.8e-06 -7.5e-06 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 1.153567166976e-14 1.44195895872e-14 ] [ -1.650241919424e-14 -1.634220153216e-14 4.646312200320001e-15 ] [ 8.65175375232e-15 2.755743787776e-14 -8.491536090240001e-15 ] [ 9.13240673856e-15 -1.12152363456e-15 3.84522388992e-15 ] [ -6.568924145279999e-15 -4.16565921408e-15 -1.554111322176e-14 ] [ 2.130894905664e-14 -5.6076181728e-15 -2.08282960704e-14 ] [ -1.249697764224e-14 -1.2016324656e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }