{ "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" [ [ 0.9949033 2.503274 2.364783 ] [ 2.081862 1.922853 4.128948 ] [ 3.003732 4.725891 2.729897 ] [ 1.175643 3.973335 4.072515 ] [ 3.741462 2.310355 2.499434 ] [ 3.610675 3.096222 4.683717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.949033000000001e-11 2.503274000000001e-10 2.364783e-10 ] [ 2.081862e-10 1.922853e-10 4.128948e-10 ] [ 3.003732e-10 4.725891e-10 2.729897e-10 ] [ 1.175643e-10 3.973335e-10 4.072515e-10 ] [ 3.741462e-10 2.310355e-10 2.499434e-10 ] [ 3.610675e-10 3.096222e-10 4.683717e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.42044 0.2205202 -2.0940958 ] [ -1.2409813 -4.0616931 1.444468 ] [ 0.0296128 -0.5352343 0.2134049 ] [ -0.3036514 1.77044 0.2642451 ] [ -0.2831544 0.4844115 -0.6631463 ] [ 2.2186143 2.1215557 0.8351241 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.73619138449152e-10 3.533123088541401e-10 -3.355111332475472e-09 ] [ -1.988271225709991e-09 -6.507549725684678e-09 2.314292859093735e-09 ] [ 4.744493583642624e-11 -8.575398821102535e-10 3.419123415441619e-10 ] [ -4.865031739531892e-10 2.836557576529152e-09 4.233673213809581e-10 ] [ -4.536633597566515e-10 7.761127801466592e-10 -1.062477498030023e-09 ] [ 3.554611962032558e-09 3.399106942264978e-09 1.338016308486641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.889261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.705957911678923e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3477951 2.074944 2.4007822 ] [ 1.7383591 2.1056356 4.7484279 ] [ 3.1252002 4.7435298 3.276684 ] [ 0.939645 4.0598012 3.6492541 ] [ 3.5333621 2.7586539 2.0282546 ] [ 3.9239158 2.7893655 4.3758911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3477951e-10 2.074944e-10 2.4007822e-10 ] [ 1.7383591e-10 2.1056356e-10 4.7484279e-10 ] [ 3.1252002e-10 4.743529800000001e-10 3.276684e-10 ] [ 9.39645e-11 4.0598012e-10 3.6492541e-10 ] [ 3.5333621e-10 2.7586539e-10 2.0282546e-10 ] [ 3.9239158e-10 2.7893655e-10 4.375891099999999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -4.4e-06 3.24e-05 ] [ -1.56e-05 3.8e-06 -7.7e-06 ] [ 1.46e-05 -3.28e-05 4.09e-05 ] [ 6.51e-05 -3.57e-05 -4.46e-05 ] [ -4.22e-05 2.85e-05 -4e-07 ] [ -1.98e-05 4.07e-05 -2.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -7.04957713152e-15 5.191052251392001e-14 ] [ -2.499395528448e-14 6.08827115904e-15 -1.233675998016e-14 ] [ 2.339177866368e-14 -5.255139316223999e-14 6.552902379072e-14 ] [ 1.0430169801408e-13 -5.719770536256001e-14 -7.145707728768e-14 ] [ -6.761185339776e-14 4.56620336928e-14 -6.408706483200001e-16 ] [ -3.172309709184e-14 6.520858846656e-14 -3.300483838848e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031374014222e-18 } }