{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.91701 1.98827 2.508844 ] [ 2.572173 1.794465 4.860558 ] [ 4.363165 1.510923 1.91691 ] [ 4.651171 2.095892 4.214607 ] [ 5.448722 3.893309 2.444809 ] [ 3.326625 3.729664 3.343147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.91701e-10 1.98827e-10 2.508844e-10 ] [ 2.572173e-10 1.794465e-10 4.860558000000001e-10 ] [ 4.363165000000001e-10 1.510923e-10 1.91691e-10 ] [ 4.651171e-10 2.095892e-10 4.214607e-10 ] [ 5.448722e-10 3.893309e-10 2.444809e-10 ] [ 3.326625e-10 3.729664e-10 3.343147e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.9049371 6.07963 6.4483576 ] [ -2.1251584 -0.2047522 -2.7357219 ] [ 0.9506401 1.5260758 6.2076004 ] [ 0.0324317 -1.5375935 -6.4901078 ] [ -7.8060281 -0.3485272 3.1673303 ] [ 3.0431776 -5.5148329 -6.5974587 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.460752168914551e-09 9.740641049114305e-09 1.0331407789278e-08 ] [ -3.404879103976735e-09 -3.280491878973657e-10 -4.383109669190556e-09 ] [ 1.523093343014974e-09 2.445042968328657e-09 9.945672232148728e-09 ] [ 5.196131151279936e-11 -2.463496357994045e-09 -1.039829898363172e-08 ] [ -1.250663572312784e-08 -5.584021315528856e-10 5.07462255701145e-09 ] [ 4.875708003662254e-09 -8.835736339998663e-09 -1.057029408583356e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3694384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.020496529210576e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5615841 2.8023152 3.4324714 ] [ 2.4341682 1.3882358 4.9074646 ] [ 5.478002 1.5581293 2.2621919 ] [ 4.5114129 1.1078974 4.1907486 ] [ 5.225416 4.2934806 2.2754792 ] [ 3.0682828 3.8624646 2.2205192 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5615841e-10 2.8023152e-10 3.4324714e-10 ] [ 2.4341682e-10 1.3882358e-10 4.9074646e-10 ] [ 5.478002000000001e-10 1.5581293e-10 2.2621919e-10 ] [ 4.5114129e-10 1.1078974e-10 4.1907486e-10 ] [ 5.225416e-10 4.2934806e-10 2.2754792e-10 ] [ 3.0682828e-10 3.8624646e-10 2.2205192e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.7569752 -0.8632211 1.0421993 ] [ 0.4652072 0.8449336 -1.519381 ] [ 0.0385252 -0.1681262 0.4342469 ] [ -0.9739121 0.0597197 0.0907657 ] [ 0.0509938 0.1003642 -0.1472321 ] [ -0.3377894 0.0263298 0.0994012 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.212807967965404e-09 -1.383032665001259e-09 1.669787352674125e-09 ] [ 7.453440996678297e-10 1.353732860048379e-09 -2.434316716287725e-09 ] [ 6.172417475164416e-11 -2.69367866983945e-10 6.957402308348755e-10 ] [ -1.560379197334232e-09 9.568150714118976e-11 1.454226825105466e-10 ] [ 8.170107416575103e-11 1.608011748052954e-10 -2.358918284512877e-10 ] [ -5.411982794340595e-10 4.218498999033984e-11 1.592582787194649e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.766774 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.04546268258373e-18 } }