{ "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" [ [ 0.0409622 2.87289 0.6143003 ] [ 0.4467191 2.12103 2.019138 ] [ 1.9155 0.4332474 1.113336 ] [ 2.832667 2.287938 0.2396185 ] [ 2.613397 2.701371 2.225579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.09622e-12 2.87289e-10 6.143003e-11 ] [ 4.467191e-11 2.12103e-10 2.019138e-10 ] [ 1.9155e-10 4.332474e-11 1.113336e-10 ] [ 2.832667e-10 2.287938e-10 2.396185e-11 ] [ 2.613397e-10 2.701371e-10 2.225579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6605709 16.6829304 -31.8326084 ] [ 6.7553835 -17.5735202 32.5529387 ] [ -2.1363874 -6.6266569 -3.8385533 ] [ -0.8133849 0.7405518 4.1308273 ] [ 3.8549596 6.7766949 -1.0126043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.227358769908035e-08 2.672900127352827e-08 -5.100146137775212e-08 ] [ 1.082331759740914e-08 -2.815588344156701e-08 5.215555775317433e-08 ] [ -3.422869973452011e-09 -1.061707484671487e-08 -6.150040405623592e-09 ] [ -1.303186281228426e-09 1.186494790226641e-09 6.618314979149308e-09 ] [ 6.176326196133985e-09 1.085746222452697e-08 -1.622370948947926e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7667198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.432773816385153e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.161339 2.8752185 0.433338 ] [ 0.4476871 2.0579309 2.1525337 ] [ 1.772712 0.0643187 1.0197 ] [ 2.6550892 2.4760477 0.3727666 ] [ 2.812418 2.9429606 2.2336336 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.61339e-11 2.8752185e-10 4.33338e-11 ] [ 4.476871e-11 2.0579309e-10 2.1525337e-10 ] [ 1.772712e-10 6.431870000000001e-12 1.0197e-10 ] [ 2.6550892e-10 2.4760477e-10 3.727666e-11 ] [ 2.812418e-10 2.9429606e-10 2.2336336e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5e-06 2.5e-06 1.91e-05 ] [ 1.43e-05 -2.27e-05 -1.53e-05 ] [ -2.08e-05 1.05e-05 -1.76e-05 ] [ 8.9e-06 -4.09e-05 4.7e-06 ] [ -5e-06 5.07e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.005441585e-15 4.005441585e-15 3.06015737094e-14 ] [ 2.29111258662e-14 -3.636940959179999e-14 -2.45133025002e-14 ] [ -3.332527398719999e-14 1.6822854657e-14 -2.81983087584e-14 ] [ 1.42593720426e-14 -6.552902433059999e-14 7.530230179799999e-15 ] [ -8.010883169999999e-15 8.123035534379999e-14 1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.088346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.776548887090736e-18 } }