{ "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" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5605139 -9.8611136 -15.4566609 ] [ -18.1878623 -0.6829722 7.3136623 ] [ -5.9934803 19.0800325 -6.7127 ] [ 15.3863512 5.5992623 -10.6775275 ] [ 7.149007 11.1350139 14.1772736 ] [ -3.6076274 -12.5007195 14.1946465 ] [ 12.8141257 -12.7695034 -2.8386941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.211327861181343e-08 -1.579924566497292e-08 -2.476430072961348e-08 ] [ -2.914016775938971e-08 -1.094242091496342e-09 1.171777874948636e-08 ] [ -9.602614013885369e-09 3.056958199560418e-08 -1.075493100244416e-08 ] [ 2.465165217205803e-08 8.971007150786837e-09 -1.710728492844907e-08 ] [ 1.145397187733555e-08 1.784025894286303e-08 2.271449630860505e-08 ] [ -5.78005627683749e-09 -2.002836052607867e-08 2.274233076282055e-08 ] [ 2.053049261253244e-08 -2.045899980670611e-08 -4.548089320622897e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 148.22476 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.37482245095691e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.892541 -1.1438608 -2.6972259 ] [ -3.9285246 2.3500084 5.4873471 ] [ 0.8716381 9.3164743 0.1556694 ] [ 9.6525292 4.9479038 -1.7966469 ] [ 6.2665527 5.4525386 8.1645081 ] [ 2.4102085 -3.9068523 10.0340112 ] [ 9.138739 -4.0008474 2.636847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.92541e-11 -1.1438608e-10 -2.6972259e-10 ] [ -3.9285246e-10 2.3500084e-10 5.4873471e-10 ] [ 8.716381e-11 9.3164743e-10 1.556694e-11 ] [ 9.652529200000001e-10 4.9479038e-10 -1.7966469e-10 ] [ 6.2665527e-10 5.4525386e-10 8.164508100000001e-10 ] [ 2.4102085e-10 -3.9068523e-10 1.00340112e-09 ] [ 9.138739e-10 -4.0008474e-10 2.636847e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }