{ "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" [ [ 2.274506 0.3236661 2.677073 ] [ 0.5953025 1.868691 3.011541 ] [ 2.644287 1.363154 4.648241 ] [ 2.19861 3.39541 3.518323 ] [ 4.456442 1.578463 3.034766 ] [ 3.361859 3.152961 1.75355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.274506e-10 3.236661e-11 2.677073e-10 ] [ 5.953025e-11 1.868691e-10 3.011541e-10 ] [ 2.644287e-10 1.363154e-10 4.648241e-10 ] [ 2.19861e-10 3.39541e-10 3.518323e-10 ] [ 4.456442e-10 1.578463e-10 3.034766e-10 ] [ 3.361859e-10 3.152961e-10 1.75355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0329823 -1.0748056 -2.8186871 ] [ -1.8663091 -0.061414 -0.455375 ] [ 0.0528584 -0.2573725 3.7195534 ] [ -0.9102075 2.8869482 2.7509854 ] [ 1.0558822 -0.6108064 0.0457662 ] [ 0.6347938 -0.8825497 -3.242243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.655020090760212e-09 -1.722028404224916e-09 -4.516034572970552e-09 ] [ -2.990156807206289e-09 -9.839607498981121e-11 -7.295911786968e-10 ] [ 8.468849269289472e-11 -4.12356202336848e-10 5.959381497297151e-09 ] [ -1.458313176576816e-09 4.625400911500642e-09 4.407564492042136e-09 ] [ 1.69170977515887e-09 -9.78619733915013e-10 7.332553566285697e-11 ] [ 1.017051785388791e-09 -1.414000496034054e-09 -5.194645933552455e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.21382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.757957995865946e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5804574 0.3032215 2.3494808 ] [ 0.790504 2.0417297 2.9209545 ] [ 2.3796875 1.1951873 4.7405155 ] [ 2.5965418 3.5908947 3.8650149 ] [ 4.386498 1.852383 3.2935449 ] [ 2.7973178 2.6989288 1.4739835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5804574e-10 3.032215e-11 2.3494808e-10 ] [ 7.90504e-11 2.0417297e-10 2.9209545e-10 ] [ 2.3796875e-10 1.1951873e-10 4.7405155e-10 ] [ 2.5965418e-10 3.5908947e-10 3.8650149e-10 ] [ 4.386498e-10 1.852383e-10 3.2935449e-10 ] [ 2.7973178e-10 2.6989288e-10 1.4739835e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8e-06 1.1e-06 1.65e-05 ] [ -1.26e-05 4.4e-06 3.5e-06 ] [ -1.34e-05 -8e-06 -9.7e-06 ] [ 6.2e-06 -7.2e-06 -6.4e-06 ] [ 1.13e-05 6e-06 -9.1e-06 ] [ 5e-07 3.8e-06 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.28174129664e-14 1.76239428288e-15 2.64359142432e-14 ] [ -2.018742542208e-14 7.04957713152e-15 5.6076181728e-15 ] [ -2.146916671872e-14 -1.28174129664e-14 -1.554111322176e-14 ] [ 9.93349504896e-15 -1.153567166976e-14 -1.025393037312e-14 ] [ 1.810459581504e-14 9.6130597248e-15 -1.457980724928e-14 ] [ 8.010883104e-16 6.08827115904e-15 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.222449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.239993500312034e-18 } }