{ "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" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.563423 -4.7210253 -6.2719456 ] [ -3.692833 -1.8460725 5.4858904 ] [ -0.7994662 3.5287955 -2.3273092 ] [ 3.306125 -2.1632273 -1.323779 ] [ 5.7495971 5.2015295 4.4371433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.311409641420999e-09 -7.563916361865307e-09 -1.004876460724943e-08 ] [ -5.916570697118726e-09 -2.957734199801808e-09 8.789365343151161e-09 ] [ -1.280886054759817e-09 5.653753649684247e-09 -3.728760389612752e-09 ] [ 5.296996180442401e-09 -3.465872205536308e-09 -2.120927764906003e-09 ] [ 9.21187005263948e-09 8.333768957301514e-09 7.109087258399361e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6280936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.608493502394107e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.889979 1.6387813 2.1607502 ] [ 1.7574732 2.0830137 4.6754731 ] [ 2.4548564 4.1321391 2.10818 ] [ 4.3853971 1.4456623 2.6844842 ] [ 3.8418423 3.4684346 4.1513364 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889979e-10 1.6387813e-10 2.1607502e-10 ] [ 1.7574732e-10 2.0830137e-10 4.6754731e-10 ] [ 2.4548564e-10 4.1321391e-10 2.10818e-10 ] [ 4.3853971e-10 1.4456623e-10 2.6844842e-10 ] [ 3.8418423e-10 3.4684346e-10 4.1513364e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.31e-05 -1.69e-05 2.5e-06 ] [ -1.12e-05 -4.5e-06 7e-07 ] [ 7.9e-06 1.26e-05 7e-07 ] [ 9.6e-06 8e-07 -4.7e-06 ] [ 6.8e-06 8e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.098851373248e-14 -2.707678489152e-14 4.005441552e-15 ] [ -1.794437815296e-14 -7.2097947936e-15 1.12152363456e-15 ] [ 1.265719530432e-14 2.018742542208e-14 1.12152363456e-15 ] [ 1.538089555968e-14 1.28174129664e-15 -7.53023011776e-15 ] [ 1.089480102144e-14 1.28174129664e-14 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }