{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5729647 -0.3802566 -0.0586162 ] [ -0.0231558 0.1926278 0.122554 ] [ 0.4454512 -0.3468202 -0.5157659 ] [ 0.712637 -0.0714269 0.1859046 ] [ 0.4380322 0.605876 0.2659236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.520167267683686e-09 -6.092382344248974e-10 -9.391350524013697e-11 ] [ -3.709968139592065e-11 3.086237576761382e-10 1.963531535855232e-10 ] [ 7.136914983473049e-10 -5.556672160611802e-10 -8.263480667858708e-10 ] [ 1.14177034051705e-09 -1.144385092762195e-10 2.978520038191757e-10 ] [ 7.018049499975897e-10 9.707203623038207e-10 4.260565748389709e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7721127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.565665050376276e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0749807 2.5126977 3.2623912 ] [ 2.9697109 4.2775415 1.8598584 ] [ 4.5792082 2.6447859 1.0687053 ] [ 4.4834871 2.3168144 3.4698686 ] [ 4.5255961 4.7340555 3.6634975 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0749807e-10 2.5126977e-10 3.2623912e-10 ] [ 2.9697109e-10 4.2775415e-10 1.8598584e-10 ] [ 4.5792082e-10 2.6447859e-10 1.0687053e-10 ] [ 4.4834871e-10 2.3168144e-10 3.4698686e-10 ] [ 4.5255961e-10 4.734055500000001e-10 3.6634975e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 8e-07 -2.6e-06 ] [ -1.68e-05 3.7e-06 -2.4e-06 ] [ 7.7e-06 -7.3e-06 -5.4e-06 ] [ -2.4e-06 2.6e-06 2.8e-06 ] [ 9e-06 3e-07 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.84522388992e-15 1.28174129664e-15 -4.16565921408e-15 ] [ -2.691656722944e-14 5.928053496960001e-15 -3.84522388992e-15 ] [ 1.233675998016e-14 -1.169588933184e-14 -8.65175375232e-15 ] [ -3.84522388992e-15 4.16565921408e-15 4.48609453824e-15 ] [ 1.44195895872e-14 4.8065298624e-16 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.415273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.668710689984948e-18 } }