{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.470604 -6.4750456 0.8968983 ] [ 0.6586304 1.4209682 -3.2091575 ] [ 0.4931271 4.4834682 2.4311482 ] [ 0.457623 -7.6053743 1.9910124 ] [ -2.0799845 8.1759835 -2.1099014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53990732666936e-10 -1.037416676440451e-08 1.436989499334322e-09 ] [ 1.055242237322074e-09 2.276642047697039e-09 -5.141637161325855e-09 ] [ 7.900767172121813e-10 7.183307989322038e-09 3.895128839831159e-09 ] [ 7.33192877780982e-10 -1.21851529962841e-08 3.189953545284262e-09 ] [ -3.332502564982173e-09 1.309936972366954e-08 -3.380434723123887e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.31555 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.65273331768587e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0516893 -0.1717586 2.3930461 ] [ 0.4147967 1.4943883 0.6303108 ] [ 0.3764598 2.1587748 3.0903365 ] [ 2.2557369 0.6874596 2.1969621 ] [ 2.0830119 3.0655106 1.5520186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.16893e-12 -1.717586e-11 2.3930461e-10 ] [ 4.147967000000001e-11 1.4943883e-10 6.303107999999999e-11 ] [ 3.764598e-11 2.1587748e-10 3.0903365e-10 ] [ 2.2557369e-10 6.874596e-11 2.1969621e-10 ] [ 2.0830119e-10 3.0655106e-10 1.5520186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.68e-05 2e-07 1.63e-05 ] [ -1.6e-06 2.46e-05 -2.32e-05 ] [ -2.3e-05 1.74e-05 6.4e-06 ] [ 1.87e-05 -2.38e-05 -4.7e-06 ] [ -1.09e-05 -1.84e-05 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.691656745119999e-14 3.204353268e-16 2.61154791342e-14 ] [ -2.5634826144e-15 3.94135451964e-14 -3.71704979088e-14 ] [ -3.6850062582e-14 2.78778734316e-14 1.02539304576e-14 ] [ 2.99607030558e-14 -3.81318038892e-14 -7.530230179799999e-15 ] [ -1.74637253106e-14 -2.94800500656e-14 8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }