{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.0494804 -6.9957048 -1.7516324 ] [ -7.8545375 7.805905 -6.2299487 ] [ 3.2116591 0.5390613 9.3142657 ] [ -1.5420681 2.1471633 1.0739821 ] [ 2.146848 -1.5592639 -0.7940949 ] [ 0.487704 -0.2652929 -0.0654684 ] [ -3.499086 -1.6718679 -1.5471035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.129451277872097e-08 -1.120835476892164e-08 -2.806424502637341e-09 ] [ -1.258435645337677e-08 1.250643859822377e-08 -9.981478238158674e-09 ] [ 5.145645166393469e-09 8.63671419153664e-10 1.492309886740765e-08 ] [ -2.470665477856775e-09 3.440134868642331e-09 1.720709025954251e-09 ] [ 3.439629702349631e-09 -2.498216186819712e-09 -1.272280293958567e-09 ] [ 7.813879531083359e-10 -4.250460855460985e-10 -1.048919407453656e-10 ] [ -5.606153829556523e-09 -2.678627684514649e-09 -2.478733078079619e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.314267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.972963085223728e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.6005094 1.0888521 2.1414162 ] [ 1.4682412 3.8258611 2.2021791 ] [ 1.9800962 1.9722779 3.7209471 ] [ 3.1230578 5.2220344 3.3037135 ] [ 4.7602399 3.3743874 2.5184579 ] [ 3.0770699 2.9843939 0.588269 ] [ 3.6465085 3.3264882 4.8568539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.6005094e-10 1.0888521e-10 2.1414162e-10 ] [ 1.4682412e-10 3.8258611e-10 2.2021791e-10 ] [ 1.9800962e-10 1.9722779e-10 3.7209471e-10 ] [ 3.123057800000001e-10 5.2220344e-10 3.3037135e-10 ] [ 4.760239900000001e-10 3.3743874e-10 2.5184579e-10 ] [ 3.0770699e-10 2.9843939e-10 5.882690000000001e-11 ] [ 3.6465085e-10 3.3264882e-10 4.8568539e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 5.1e-06 -1.4e-06 ] [ 3e-06 -5.3e-06 2.4e-06 ] [ 8e-07 -1.03e-05 3.5e-06 ] [ 8.5e-06 3e-06 -5.6e-06 ] [ -6.5e-06 -1.23e-05 2.3e-06 ] [ -3.6e-06 1.1e-05 -1.3e-06 ] [ -7.1e-06 8.9e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.530230179799999e-15 8.1711008334e-15 -2.2430472876e-15 ] [ 4.806529901999999e-15 -8.4915361602e-15 3.845223921599999e-15 ] [ 1.2817413072e-15 -1.65024193302e-14 5.607618218999999e-15 ] [ 1.3618501389e-14 4.806529901999999e-15 -8.972189150399999e-15 ] [ -1.0414148121e-14 -1.97067725982e-14 3.685006258199999e-15 ] [ -5.767835882399999e-15 1.7623942974e-14 -2.0828296242e-15 ] [ -1.13754541014e-14 1.42593720426e-14 1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586672135423e-18 } }