{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.992977 1.520628 1.322916 ] [ 2.351443 2.977576 3.35114 ] [ 0.8368319 3.514349 1.69894 ] [ 2.887807 3.844369 0.5466762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992977e-10 1.520628e-10 1.322916e-10 ] [ 2.351443e-10 2.977576e-10 3.35114e-10 ] [ 8.368319e-11 3.514349e-10 1.69894e-10 ] [ 2.887807e-10 3.844369e-10 5.466762e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4563363 -1.3553796 -0.47583 ] [ 0.5633776 -0.0923155 1.3838951 ] [ -1.4249608 1.1413218 -0.2968112 ] [ 0.4052469 0.3063733 -0.6112539 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.31131351082375e-10 -2.171557507429256e-09 -7.62363701475264e-10 ] [ 9.026304194024142e-10 -1.479057358374624e-10 2.217244374859678e-09 ] [ -2.283038879316465e-09 1.828599104769373e-09 -4.755439654315929e-10 ] [ 6.492771088316755e-10 4.908641384973447e-10 -9.793367079528211e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4840522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.038859684288681e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.944498 1.6090348 1.4943128 ] [ 1.7273478 2.4939335 3.2940749 ] [ 1.0900317 4.3194263 1.9655235 ] [ 2.3071814 3.4345273 0.165761 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.944498e-10 1.6090348e-10 1.4943128e-10 ] [ 1.7273478e-10 2.4939335e-10 3.2940749e-10 ] [ 1.0900317e-10 4.3194263e-10 1.9655235e-10 ] [ 2.3071814e-10 3.4345273e-10 1.65761e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 2.9e-06 -6e-07 ] [ -9e-07 -2e-07 3.1e-06 ] [ 2.2e-06 -3.2e-06 -8e-07 ] [ 5e-07 5e-07 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 4.646312200320001e-15 -9.6130597248e-16 ] [ -1.44195895872e-15 -3.2043532416e-16 4.96674752448e-15 ] [ 3.52478856576e-15 -5.126965186560001e-15 -1.28174129664e-15 ] [ 8.010883104e-16 8.010883104e-16 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4643956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195928011872239e-18 } }