{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6301794 -4.6389665 -0.812645 ] [ 0.1524908 -0.1420906 0.475429 ] [ -1.0832769 4.7371423 -0.4756069 ] [ 2.7516002 0.0732654 -0.5859169 ] [ 0.8093654 -0.0293507 1.3987398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.214011943189771e-09 -7.432443670974404e-09 -1.302000820010016e-09 ] [ 2.443171946470887e-10 -2.276542373554445e-10 7.617212286503232e-10 ] [ -1.7356009230327e-09 7.589738642462741e-09 -7.620062558711636e-10 ] [ 4.408549510228604e-09 1.173841109935603e-10 -9.387423589116114e-10 ] [ 1.29674632156444e-09 -4.702500534411456e-11 2.241028206142468e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.410342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.667920656693231e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6884794 1.5970523 1.4715617 ] [ 1.3740679 2.5513979 3.7241166 ] [ 2.2988992 4.1362591 1.8313579 ] [ 4.0763363 2.2105376 1.5449531 ] [ 3.761921 3.1649032 3.7974887 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6884794e-10 1.5970523e-10 1.4715617e-10 ] [ 1.3740679e-10 2.5513979e-10 3.7241166e-10 ] [ 2.2988992e-10 4.1362591e-10 1.8313579e-10 ] [ 4.076336300000001e-10 2.2105376e-10 1.5449531e-10 ] [ 3.761921e-10 3.1649032e-10 3.7974887e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.96e-05 1.74e-05 2.78e-05 ] [ 3.7e-06 -1.33e-05 -1.46e-05 ] [ 5.2e-06 8e-07 -1.54e-05 ] [ -2.42e-05 1.7e-06 -4.8e-06 ] [ -4.3e-06 -6.6e-06 7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.140266176767999e-14 2.787787320192e-14 4.454051005824e-14 ] [ 5.928053496960001e-15 -2.130894905664e-14 -2.339177866368e-14 ] [ 8.33131842816e-15 1.28174129664e-15 -2.467351996032e-14 ] [ -3.877267422336e-14 2.72370025536e-15 -7.69044777984e-15 ] [ -6.889359469440001e-15 -1.057436569728e-14 1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }