{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -76.900706 -103.889815 -68.6390019 ] [ 1.1119786 -33.6692977 57.6930229 ] [ 83.6044628 108.315257 -38.2768855 ] [ -28.6990204 38.4720696 50.2629664 ] [ 13.1502716 -20.1850013 -12.3906758 ] [ 7.7330134 10.9567875 11.350574 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.232085142913036e-07 -1.664498341035827e-07 -1.099718050252616e-07 ] [ 1.781586130428032e-09 -5.394416205812993e-08 9.243441323520691e-08 ] [ 1.339491167962822e-07 1.735401738711049e-07 -6.13263315703934e-08 ] [ -4.598089990356933e-08 6.163905097474172e-08 8.05301503216071e-08 ] [ 2.106905788827379e-08 -3.233993744011962e-08 -1.985205124622926e-08 ] [ 1.238965337988889e-08 1.755470891620328e-08 1.818562444528791e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 48.505301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.771405988733683e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3290132 0.6048757 0.6084542 ] [ 0.4355167 0.6299024 3.1527726 ] [ 1.2451 2.6916611 1.0840397 ] [ -0.3772786 3.0548791 3.03131 ] [ 2.2407511 0.0573187 1.0684014 ] [ 2.8253068 1.7827631 3.01679 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.290132e-11 6.048757000000001e-11 6.084542e-11 ] [ 4.355167e-11 6.299024e-11 3.1527726e-10 ] [ 1.2451e-10 2.6916611e-10 1.0840397e-10 ] [ -3.772786e-11 3.0548791e-10 3.03131e-10 ] [ 2.2407511e-10 5.73187e-12 1.0684014e-10 ] [ 2.8253068e-10 1.7827631e-10 3.01679e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.73e-05 -1.7e-06 -1.14e-05 ] [ -2.24e-05 2.2e-06 1.57e-05 ] [ -1.61e-05 2.67e-05 -7.1e-06 ] [ 4.8e-06 -7.5e-06 -5.6e-06 ] [ 3.29e-05 -1.88e-05 -4.4e-06 ] [ 2.82e-05 -1e-06 1.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.37394221082e-14 -2.7237002778e-15 -1.82648136276e-14 ] [ -3.588875660159999e-14 3.5247885948e-15 2.515417315379999e-14 ] [ -2.579504380739999e-14 4.277811612779999e-14 -1.13754541014e-14 ] [ 7.690447843199998e-15 -1.2016324755e-14 -8.972189150399999e-15 ] [ 5.271161125859999e-14 -3.012092071919999e-14 -7.0495771896e-15 ] [ 4.51813810788e-14 -1.602176634e-15 2.03476432518e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.570354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.135516389790843e-18 } }