{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8921187 3.1569263 -3.1414356 ] [ 0.2474693 5.1922047 -1.9410721 ] [ -2.862113 -3.2943383 2.4417261 ] [ -0.5775571 -4.0398319 7.0387742 ] [ 0.300082 -1.0149607 -4.3979926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.63368496571849e-09 5.057953511448647e-09 -5.03313467406882e-09 ] [ 3.964895268257415e-10 8.318828980747877e-09 -3.109940337907159e-09 ] [ -4.585610534687751e-09 -5.278111805266017e-09 3.912076471817163e-09 ] [ -9.253484827970477e-10 -6.472524222142044e-09 1.127735946233022e-08 ] [ 4.807843647229056e-10 -1.626146304570803e-09 -7.046360922171407e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4342566 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.706638875948098e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2534471 -0.5268641 1.8555859 ] [ 1.4383585 2.7418994 1.9931967 ] [ 2.8264643 4.0941254 0.9546796 ] [ 3.4230927 1.2673889 2.3614181 ] [ 4.2751964 2.9812453 3.4463986 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2534471e-10 -5.268641e-11 1.8555859e-10 ] [ 1.4383585e-10 2.7418994e-10 1.9931967e-10 ] [ 2.8264643e-10 4.0941254e-10 9.546796e-11 ] [ 3.4230927e-10 1.2673889e-10 2.3614181e-10 ] [ 4.2751964e-10 2.9812453e-10 3.4463986e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0311093 0.0384399 -0.002896 ] [ 0.0111945 0.0133085 -0.0096822 ] [ -0.0125943 -0.0122678 0.0094219 ] [ -0.0587342 -0.0851174 -0.0113578 ] [ 0.0290247 0.0456369 0.0145141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.984259314945345e-11 6.158750908588992e-11 -4.6399034938368e-12 ] [ 1.79355661815456e-11 2.13225675579168e-11 -1.551259447790976e-11 ] [ -2.017829301534144e-11 -1.965518234865024e-11 1.509554790351552e-11 ] [ -9.410256208139136e-11 -1.363731083032819e-10 -1.819720162372224e-11 ] [ 4.650269576573376e-11 7.311837422578752e-11 2.325415169195328e-11 ] ] } "relaxed-potential-energy" { "source-value" -8.536761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367739889155723e-18 } }