{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2618964 -0.262121 -1.1344335 ] [ -0.5798557 -0.7135492 1.3227209 ] [ -1.1744515 -0.0605415 -0.9482072 ] [ -1.4238081 0.5683734 -2.1700821 ] [ 1.0127029 0.1901422 1.8453918 ] [ 0.102268 -0.5990509 0.5819188 ] [ 1.8012479 0.8767471 0.5026912 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.196042891516851e-10 -4.199641380207168e-10 -1.817562831552317e-09 ] [ -9.290312459776185e-10 -1.143231846030543e-09 2.119232501823535e-09 ] [ -1.881678735563491e-09 -9.69981758881632e-11 -1.51919540751423e-09 ] [ -2.281192050325669e-09 9.106345733646069e-10 -3.476854805836568e-09 ] [ 1.62252891019636e-09 3.046413874674778e-10 2.956643598176029e-09 ] [ 1.638513986559744e-10 -9.597853466491989e-10 9.323366965639909e-10 ] [ 2.885917273645096e-09 1.4047037059742e-09 8.05400088121897e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.453880085572457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.35446090281509e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4151262 1.7307217 2.4588224 ] [ 2.4157796 2.147073 4.7738436 ] [ 1.5425095 3.7659819 3.2518663 ] [ 4.5139297 1.9249816 1.4612876 ] [ 4.5424649 2.2329021 3.7725978 ] [ 3.6096586 3.9621735 2.146826 ] [ 3.5340315 4.2361082 4.4817633 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4151262e-10 1.7307217e-10 2.4588224e-10 ] [ 2.4157796e-10 2.147073e-10 4.7738436e-10 ] [ 1.5425095e-10 3.7659819e-10 3.2518663e-10 ] [ 4.5139297e-10 1.9249816e-10 1.4612876e-10 ] [ 4.5424649e-10 2.2329021e-10 3.7725978e-10 ] [ 3.6096586e-10 3.9621735e-10 2.146826e-10 ] [ 3.5340315e-10 4.2361082e-10 4.4817633e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 -3.01e-05 3.05e-05 ] [ -3.37e-05 1.02e-05 9e-07 ] [ 1.29e-05 -3.2e-06 -2.25e-05 ] [ 1.34e-05 1.96e-05 -3.8e-05 ] [ -1.01e-05 4.5e-06 1.8e-05 ] [ -2.43e-05 1.14e-05 1.91e-05 ] [ 3.9e-05 -1.24e-05 -8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 -4.822551628608e-14 4.88663869344e-14 ] [ -5.399335212096e-14 1.634220153216e-14 1.44195895872e-15 ] [ 2.066807840832e-14 -5.126965186560001e-15 -3.604897396800001e-14 ] [ 2.146916671872e-14 3.140266176767999e-14 -6.08827115904e-14 ] [ -1.618198387008e-14 7.2097947936e-15 2.88391791744e-14 ] [ -3.893289188544e-14 1.826481347712e-14 3.060157345728e-14 ] [ 6.248488821120001e-14 -1.986699009792e-14 -1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }