{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3604332 -0.0293662 8.4368689 ] [ -1.1719125 -0.5023559 1.4095648 ] [ 9.8267504 -31.073335 7.5481365 ] [ 138.5043105 14.5576398 52.4805933 ] [ -137.7987152 17.0474174 -69.8751635 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.499706723360013e-08 -4.704983908173696e-11 1.351735410433461e-08 ] [ -1.87761080912328e-09 -8.048628783009428e-10 2.258371768062628e-09 ] [ 1.574418974931705e-08 -4.978497086728637e-08 1.209344783090714e-08 ] [ 2.21908368163124e-07 2.332391014158759e-08 8.408317963097312e-08 ] [ -2.207778798697176e-07 2.731297360329912e-08 -1.119523533342775e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 36.112354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.785836930085337e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1027026 0.4349786 3.1880684 ] [ -0.0761604 2.134971 2.1242308 ] [ 2.5200733 0.2218994 1.3522123 ] [ 3.6002892 2.2640643 0.7999007 ] [ 1.3063184 1.9722084 0.2568871 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1027026e-10 4.349786e-11 3.1880684e-10 ] [ -7.61604e-12 2.134971e-10 2.1242308e-10 ] [ 2.5200733e-10 2.218994e-11 1.3522123e-10 ] [ 3.6002892e-10 2.2640643e-10 7.999007e-11 ] [ 1.3063184e-10 1.9722084e-10 2.568871e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 3.9e-06 -6e-07 ] [ -6.2e-06 1.2e-05 -6e-06 ] [ 1.6e-05 1.2e-06 -1.39e-05 ] [ -2.12e-05 -1.36e-05 1.12e-05 ] [ 3.6e-06 -3.4e-06 9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.249697764224e-14 6.24848882112e-15 -9.6130597248e-16 ] [ -9.93349504896e-15 1.92261194496e-14 -9.6130597248e-15 ] [ 2.56348259328e-14 1.92261194496e-15 -2.227025502912e-14 ] [ -3.396614436096001e-14 -2.178960204288e-14 1.794437815296e-14 ] [ 5.76783583488e-15 -5.44740051072e-15 1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.846295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.218421013369993e-18 } }