{ "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" [ [ 0.9320143 3.012582 2.150962 ] [ 2.172573 2.316103 4.293659 ] [ 2.198257 4.51425 3.345177 ] [ 3.106694 2.5483 1.973249 ] [ 3.92193 5.175884 1.747773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320143e-11 3.012582e-10 2.150962e-10 ] [ 2.172573e-10 2.316103e-10 4.293659e-10 ] [ 2.198257e-10 4.51425e-10 3.345177e-10 ] [ 3.106694e-10 2.5483e-10 1.973249e-10 ] [ 3.92193e-10 5.175884e-10 1.747773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3368426 -0.1829602 -0.4802677 ] [ 0.5583345 -0.0369871 -0.5998743 ] [ 0.7368224 1.3175399 0.1172489 ] [ 1.7104326 -0.1668701 0.2960178 ] [ -0.6687469 -0.9307225 0.6668753 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.744034580209487e-09 -2.931345549768922e-10 -7.694736806653882e-10 ] [ 8.945504824860576e-10 -5.925986689119168e-11 -9.611045788787654e-10 ] [ 1.180519622961746e-09 2.11093162475117e-09 1.878534463945171e-10 ] [ 2.740415123174158e-09 -2.673553729305581e-10 4.742727985006503e-10 ] [ -1.071450648412476e-09 -1.491181829952528e-09 1.068452014648986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.98986 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.920987337866509e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0149464 3.0181481 2.1081648 ] [ 2.3001246 2.5234657 4.0873986 ] [ 2.0456317 4.8104353 3.6136506 ] [ 3.2582196 2.4590929 1.7882132 ] [ 3.7125459 4.755977 1.9133928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0149464e-10 3.0181481e-10 2.1081648e-10 ] [ 2.3001246e-10 2.5234657e-10 4.0873986e-10 ] [ 2.0456317e-10 4.8104353e-10 3.6136506e-10 ] [ 3.2582196e-10 2.4590929e-10 1.7882132e-10 ] [ 3.7125459e-10 4.755977e-10 1.9133928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.4783681 0.1029494 0.221261 ] [ 0.2083912 -0.1112169 -0.5528872 ] [ 0.2092107 0.0493746 -0.4144175 ] [ 0.2561839 0.0176321 0.4211083 ] [ -0.1954176 -0.0587391 0.3249354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.664301859565165e-10 1.649431218053875e-10 3.544992012948288e-10 ] [ 3.338795086204569e-10 -1.781891170178515e-10 -8.858229457795738e-10 ] [ 3.351924923612026e-10 7.910682978135168e-11 -6.63970029750384e-10 ] [ 4.104518552053652e-10 2.824973839560768e-11 6.746898730848326e-10 ] [ -3.130935100128461e-10 -9.41104127468333e-11 5.206039011502963e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.666308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.189583917025201e-18 } }