{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3093173 2.418858 0.7919509 ] [ -2.2190307 -3.4705476 -5.7269953 ] [ -7.7243578 0.0735165 4.8568823 ] [ 4.3909897 -2.1641375 -0.0514313 ] [ -3.2486305 -2.0313165 3.29269 ] [ 10.8296237 0.3229268 2.5491543 ] [ -2.3379117 4.8507004 -5.7122509 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.955809464689798e-10 3.875437736635047e-09 1.268845216801519e-09 ] [ -3.555279108377458e-09 -5.56043022609355e-09 -9.175657977091482e-09 ] [ -1.237578547785412e-08 1.177864175430432e-10 7.78158327103733e-09 ] [ 7.035141039513607e-09 -3.46733050669656e-09 -8.240202643735104e-11 ] [ -5.204879836717814e-09 -3.254527805745283e-09 5.275470937541952e-09 ] [ 1.735096990420159e-08 5.173857691897574e-10 4.08419542227179e-09 ] [ -3.745747467234784e-09 7.771678775385208e-09 -9.15203484412376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1195261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.46110915101954e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3759472 2.5416017 2.0555503 ] [ 2.7036096 -0.0016293 4.3132064 ] [ 0.8917483 1.0481591 4.990123 ] [ 2.05542 3.848733 2.6191174 ] [ 4.7969909 0.3100852 3.7074394 ] [ 5.6047392 2.3070131 3.2399375 ] [ 4.2260298 4.001996 2.9504181 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.759472e-11 2.5416017e-10 2.0555503e-10 ] [ 2.7036096e-10 -1.6293e-13 4.3132064e-10 ] [ 8.917483000000001e-11 1.0481591e-10 4.990123e-10 ] [ 2.05542e-10 3.848733000000001e-10 2.6191174e-10 ] [ 4.7969909e-10 3.100852e-11 3.7074394e-10 ] [ 5.6047392e-10 2.3070131e-10 3.2399375e-10 ] [ 4.2260298e-10 4.001996e-10 2.9504181e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0498589 0.1648995 0.049325 ] [ -0.1147652 -0.1624983 0.1065011 ] [ -0.0638264 -0.1110683 0.0067234 ] [ -0.2906004 0.0509969 -0.1258702 ] [ 0.1835841 0.1817216 -0.0078548 ] [ -0.0130319 -0.0086033 0.0043574 ] [ 0.2487809 -0.1154481 -0.033182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.988276391880512e-11 2.641981236816096e-10 7.902736182096e-11 ] [ -1.838741203214362e-10 -2.603509771797447e-10 1.706335725094829e-10 ] [ -1.022611658698291e-10 -1.779510335720006e-10 1.077207429228672e-11 ] [ -4.655931668751283e-10 8.170604091327552e-11 -2.016662916954201e-10 ] [ 2.941341529706093e-10 2.911500990143693e-10 -1.258477692105984e-11 ] [ -2.087940550460352e-11 -1.378400612172864e-11 6.98132440747392e-12 ] [ 3.985909416815827e-10 -1.849682467357805e-10 -5.31634246313856e-11 ] ] } "relaxed-potential-energy" { "source-value" -15.910155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.549087837430422e-18 } }