{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2403614 -0.4938442 -6.5054844 ] [ -7.0762184 -10.0464988 7.0545407 ] [ -6.3433026 5.5295162 3.7332576 ] [ 2.8653362 -8.1205355 -9.076962 ] [ 8.3533111 -6.7795621 3.5360803 ] [ 5.7934513 11.65105 -6.3528445 ] [ 2.6477838 8.2598745 7.6114123 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.998161140422758e-09 -7.912256315576794e-10 -1.042293501265912e-08 ] [ -1.133735168415478e-08 -1.609626549825526e-08 1.130262018002207e-08 ] [ -1.016309112437985e-08 8.859261579974856e-09 5.981338046143918e-09 ] [ 4.590774670371913e-09 -1.301053212647644e-08 -1.454289630429001e-08 ] [ 1.338347975068913e-08 -1.086205589588175e-08 5.665425185931451e-09 ] [ 9.282132226603367e-09 1.866703991777184e-08 -1.017837893347787e-08 ] [ 4.242217301292983e-09 1.323377781464209e-08 1.219482683832956e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4664016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.516684732662371e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1496712 3.0753907 1.0318533 ] [ 2.4020655 1.065753 4.1428946 ] [ 1.8294544 3.2706422 3.3990358 ] [ 4.3293195 1.6865477 1.0314122 ] [ 4.6422286 1.4783499 3.3984672 ] [ 4.4501227 4.2808796 1.2571019 ] [ 4.1907401 3.8730159 3.611436 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1496712e-10 3.0753907e-10 1.0318533e-10 ] [ 2.4020655e-10 1.065753e-10 4.1428946e-10 ] [ 1.8294544e-10 3.2706422e-10 3.3990358e-10 ] [ 4.329319500000001e-10 1.6865477e-10 1.0314122e-10 ] [ 4.6422286e-10 1.4783499e-10 3.3984672e-10 ] [ 4.4501227e-10 4.2808796e-10 1.2571019e-10 ] [ 4.190740100000001e-10 3.8730159e-10 3.611436e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 1.2e-05 1.16e-05 ] [ 1.47e-05 3.79e-05 -2.1e-05 ] [ 3.54e-05 -2.82e-05 -5.3e-06 ] [ -1.25e-05 6e-07 5.3e-06 ] [ 1.2e-06 8.5e-06 3.1e-06 ] [ 9.3e-06 -2.06e-05 1.57e-05 ] [ -3.94e-05 -1.02e-05 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 1.92261194496e-14 1.858524880128e-14 ] [ 2.355199632576e-14 6.072249392832e-14 -3.36457090368e-14 ] [ 5.671705237632e-14 -4.518138070656001e-14 -8.491536090240001e-15 ] [ -2.002720776e-14 9.6130597248e-16 8.491536090240001e-15 ] [ 1.92261194496e-15 1.36185012768e-14 4.96674752448e-15 ] [ 1.490024257344e-14 -3.300483838848e-14 2.515417294656e-14 ] [ -6.312575885952001e-14 -1.634220153216e-14 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }