{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2013304 -3.5035313 4.3943486 ] [ -2.3117941 -0.4570563 -7.5337059 ] [ -0.7516942 -0.5054793 0.029524 ] [ 3.1854222 6.8822819 2.8554434 ] [ 5.0793965 -2.416215 0.2543899 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.333450032593871e-09 -5.613275985347643e-09 7.040522648570611e-09 ] [ -3.703902489639059e-09 -7.322849242824941e-10 -1.207032756040794e-08 ] [ -1.204346883153323e-09 -8.098671234306761e-10 4.730266294221599e-11 ] [ 5.103609018264874e-09 1.102663124878112e-08 4.574924695189515e-09 ] [ 8.138090387121379e-09 -3.871203215720309e-09 4.075775537055966e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.982498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.080025494655173e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5942083 2.5474271 3.9728579 ] [ 1.9786271 3.3516848 1.5520215 ] [ 0.4588223 4.6810468 3.1268641 ] [ 2.9883014 4.6714064 3.5253323 ] [ 3.9152708 2.3659679 2.9066113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5942083e-10 2.5474271e-10 3.9728579e-10 ] [ 1.9786271e-10 3.3516848e-10 1.5520215e-10 ] [ 4.588223e-11 4.6810468e-10 3.1268641e-10 ] [ 2.9883014e-10 4.671406400000001e-10 3.5253323e-10 ] [ 3.9152708e-10 2.3659679e-10 2.9066113e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.9e-06 2.1e-06 1.8e-06 ] [ 3.7e-06 1.7e-06 -2e-07 ] [ -3.5e-06 -1.9e-06 -5e-07 ] [ 1e-06 -2e-07 3e-07 ] [ -4.2e-06 -1.8e-06 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.6463122386e-15 3.364570931399999e-15 2.8839179412e-15 ] [ 5.9280535458e-15 2.7237002778e-15 -3.204353268e-16 ] [ -5.607618218999999e-15 -3.0441356046e-15 -8.010883169999999e-16 ] [ 1.602176634e-15 -3.204353268e-16 4.806529901999999e-16 ] [ -6.729141862799999e-15 -2.8839179412e-15 -2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.582415215248651e-18 } }