{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -61.2458708 -38.7277679 -47.3224537 ] [ -344.0453438 -38.8654246 103.472101 ] [ 14.8804175 -69.0816688 222.967183 ] [ 73.3375508 32.6146714 29.0533521 ] [ 317.0732462 114.0601899 -308.1701824 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.81267023162974e-08 -6.204872430514872e-08 -7.581892895703045e-08 ] [ -5.512214063314582e-07 -6.226927465158519e-08 1.657805811272563e-07 ] [ 2.384105702624318e-08 -1.106810346772088e-07 3.572328078082352e-07 ] [ 1.174997093184923e-07 5.22544640121544e-08 4.654860149049059e-08 ] [ 5.080073421428024e-07 1.827445696217883e-07 -4.937430614689516e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 120.81762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.935711661446985e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8779857 -0.1754711 1.2148851 ] [ 0.1132398 2.3304294 0.9091339 ] [ 1.0117775 1.6172961 3.2844049 ] [ 3.0875027 1.1745802 1.7181267 ] [ 2.4320496 3.0613824 0.1260162 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.779857e-11 -1.754711e-11 1.2148851e-10 ] [ 1.132398e-11 2.3304294e-10 9.091339e-11 ] [ 1.0117775e-10 1.6172961e-10 3.2844049e-10 ] [ 3.0875027e-10 1.1745802e-10 1.7181267e-10 ] [ 2.4320496e-10 3.0613824e-10 1.260162e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 3.7e-06 -2.4e-06 ] [ -1.17e-05 -2.8e-06 -1.11e-05 ] [ 1.37e-05 -3.4e-06 1.2e-05 ] [ -2e-05 1.7e-05 -1.04e-05 ] [ 1.5e-05 -1.45e-05 1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-15 5.928053496960001e-15 -3.84522388992e-15 ] [ -1.874546646336e-14 -4.48609453824e-15 -1.778416049088e-14 ] [ 2.194981970496e-14 -5.44740051072e-15 1.92261194496e-14 ] [ -3.2043532416e-14 2.72370025536e-14 -1.666263685632e-14 ] [ 2.4032649312e-14 -2.32315610016e-14 1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }