{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0807791 -0.0860225 -0.0476213 ] [ -41.8371902 -14.9127203 29.2218067 ] [ -6.5891762 0.1444337 1.2095676 ] [ 2.3556981 10.779539 -19.3777015 ] [ 40.1519824 -7.2998138 -14.4412577 ] [ 5.8379068 11.3745839 3.4352061 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.294223854692653e-10 -1.37823238362768e-10 -7.629773351210305e-11 ] [ -6.703056801840288e-08 -2.389281181718956e-08 4.68184955122768e-08 ] [ -1.055702405797178e-08 2.31408297395641e-10 1.937940929997166e-09 ] [ 3.774244421482981e-09 1.727072536880181e-08 -3.104650030814109e-08 ] [ 6.433056748005308e-08 -1.169559100655321e-08 -2.313744546188798e-08 ] [ 9.35335778936934e-09 1.822409239590809e-08 5.503806901049546e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.2110488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.144667315607895e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1571456 1.3275988 0.5599786 ] [ 0.782759 -0.0636005 2.4182169 ] [ 0.4532837 2.295953 2.7404584 ] [ 2.4257969 1.7096879 0.0822113 ] [ 3.0514116 0.3184101 1.9403932 ] [ 2.7219569 2.6779484 2.2627203 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.571456e-11 1.3275988e-10 5.599786e-11 ] [ 7.82759e-11 -6.360050000000001e-12 2.4182169e-10 ] [ 4.532837e-11 2.295953e-10 2.7404584e-10 ] [ 2.4257969e-10 1.7096879e-10 8.22113e-12 ] [ 3.0514116e-10 3.184101e-11 1.9403932e-10 ] [ 2.7219569e-10 2.6779484e-10 2.2627203e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-05 5.37e-05 3.72e-05 ] [ -1.82e-05 -8.2e-06 -3.07e-05 ] [ 1.6e-06 -5.65e-05 -4.5e-06 ] [ 1.24e-05 -6.05e-05 -2.94e-05 ] [ 1.54e-05 -1.33e-05 2.02e-05 ] [ 2.8e-06 8.48e-05 7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-14 8.603688453696e-14 5.960097029376001e-14 ] [ -2.915961449856e-14 -1.313784829056e-14 -4.918682225856e-14 ] [ 2.56348259328e-15 -9.052297907519999e-14 -7.2097947936e-15 ] [ 1.986699009792e-14 -9.69316855584e-14 -4.710399265152e-14 ] [ 2.467351996032e-14 -2.130894905664e-14 3.236396774016e-14 ] [ 4.48609453824e-15 1.3586457744384e-13 1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.817009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.014817189318319e-18 } }