{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2949929 -4.9278427 -10.0721832 ] [ 2.0735157 -5.9993254 11.3594843 ] [ -4.7654122 -2.0739534 0.1509479 ] [ -5.849651 9.6681633 1.2608916 ] [ 8.8365404 3.3329582 -2.6991407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.726307276819923e-10 -7.895274364919949e-09 -1.613741644345453e-08 ] [ 3.322138377401747e-09 -9.611978896451609e-09 1.819990016980465e-08 ] [ -7.635032015315094e-09 -3.322839650108671e-09 2.418451963388563e-10 ] [ -9.37217407203934e-09 1.549010520533658e-08 2.020171042883105e-09 ] [ 1.415769843763468e-08 5.339987706143651e-09 -4.324500125789747e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.3574572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.77706281037663e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.086674 2.1074167 1.7758509 ] [ 2.5088314 2.0462411 4.9123145 ] [ 0.5075576 2.3163546 3.589708 ] [ 1.2631545 4.6083354 3.532714 ] [ 3.3982169 3.5249692 3.2242086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.086674e-10 2.1074167e-10 1.7758509e-10 ] [ 2.5088314e-10 2.0462411e-10 4.9123145e-10 ] [ 5.075576000000001e-11 2.3163546e-10 3.589708e-10 ] [ 1.2631545e-10 4.6083354e-10 3.532714e-10 ] [ 3.3982169e-10 3.5249692e-10 3.2242086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-07 4e-07 9.8e-06 ] [ -1.5e-06 -1.3e-06 -1.13e-05 ] [ 1.12e-05 8.4e-06 9e-07 ] [ 1.4e-06 -6.3e-06 -3.1e-06 ] [ -1.14e-05 -1.3e-06 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706483200001e-16 6.408706483200001e-16 1.570133088384e-14 ] [ -2.4032649312e-15 -2.08282960704e-15 -1.810459581504e-14 ] [ 1.794437815296e-14 1.345828361472e-14 1.44195895872e-15 ] [ 2.24304726912e-15 -1.009371271104e-14 -4.96674752448e-15 ] [ -1.826481347712e-14 -2.08282960704e-15 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }