{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6847421 -7.614797 -13.4397248 ] [ -74.4898744 -74.1994019 92.5202076 ] [ -14.7466952 -13.6093131 3.0444565 ] [ -8.2343364 24.736812 5.6221045 ] [ 93.7861638 70.6867001 -87.7470437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.903607646297496e-09 -1.220024972553798e-08 -2.153281286454596e-08 ] [ -1.193459352500084e-07 -1.188805470015231e-07 1.482337135682825e-07 ] [ -2.362681028350358e-08 -2.180452327396717e-08 4.877757027342595e-09 ] [ -1.319286126788244e-08 3.963274185952489e-08 9.007604389594473e-09 ] [ 1.502619989948793e-07 1.13252578301721e-07 -1.405862619604559e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 12.405641 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.987602797623793e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0738539 2.1967132 1.9524761 ] [ 2.4150571 2.127252 4.7527491 ] [ -0.0252855 2.1445484 3.6287382 ] [ 1.3697501 4.4380262 3.5156544 ] [ 3.9310586 3.6967771 3.1851783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0738539e-10 2.1967132e-10 1.9524761e-10 ] [ 2.4150571e-10 2.127252e-10 4.7527491e-10 ] [ -2.52855e-12 2.1445484e-10 3.6287382e-10 ] [ 1.3697501e-10 4.4380262e-10 3.5156544e-10 ] [ 3.9310586e-10 3.6967771e-10 3.1851783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-05 1.56e-05 4.05e-05 ] [ -2.51e-05 -9.2e-06 -2.28e-05 ] [ 5.67e-05 1.21e-05 -1.6e-06 ] [ 1.11e-05 -1.58e-05 -1.5e-05 ] [ -3.07e-05 -2.6e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92261194496e-14 2.499395528448e-14 6.488815314240001e-14 ] [ -4.021463318208e-14 -1.474002491136e-14 -3.652962695424e-14 ] [ 9.084341439936e-14 1.938633711168e-14 -2.56348259328e-15 ] [ 1.778416049088e-14 -2.531439060864e-14 -2.4032649312e-14 ] [ -4.918682225856e-14 -4.16565921408e-15 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.92185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.711179245068448e-18 } }