{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2703886 -11.8221948 1.3145379 ] [ -1.9783908 3.9179425 -8.206052 ] [ -7.7027494 6.9977861 2.9695962 ] [ 2.7442041 -5.5042586 -2.7770836 ] [ 1.4943476 -1.7161443 -0.0302356 ] [ 12.4776994 9.7597521 -1.8078418 ] [ 3.2352777 -1.6328829 8.5370789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.645497650145084e-08 -1.894124411510333e-08 2.106121890535528e-09 ] [ -3.169731486565809e-09 6.277235875138704e-09 -1.314754466346908e-08 ] [ -1.234116500456123e-08 1.121168928677921e-08 4.757817604856521e-09 ] [ 4.396699651723506e-09 -8.81879444375734e-09 -4.4493784179271e-09 ] [ 2.39420878806859e-09 -2.749566275379182e-09 -4.844277143586048e-11 ] [ 1.999147826005019e-08 1.56368466394237e-08 -2.89648186606499e-09 ] [ 5.183486292735597e-09 -2.616166806884105e-09 1.367790822350498e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2116247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.349943250723814e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5282044 1.6308257 2.6386938 ] [ 3.1545401 4.1013611 1.2988544 ] [ 1.9206384 3.8099936 3.264572 ] [ 3.5093567 1.6937781 1.4707616 ] [ 5.0544247 2.2893152 3.1229046 ] [ 5.3039213 4.3288008 2.0871544 ] [ 3.6122014 3.1715785 4.6429424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5282044e-10 1.6308257e-10 2.6386938e-10 ] [ 3.1545401e-10 4.1013611e-10 1.2988544e-10 ] [ 1.9206384e-10 3.8099936e-10 3.264572e-10 ] [ 3.5093567e-10 1.6937781e-10 1.4707616e-10 ] [ 5.0544247e-10 2.2893152e-10 3.1229046e-10 ] [ 5.3039213e-10 4.3288008e-10 2.0871544e-10 ] [ 3.6122014e-10 3.1715785e-10 4.6429424e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 -5.78e-05 2.86e-05 ] [ 6.8e-05 -2.64e-05 -6e-06 ] [ -2.75e-05 5.78e-05 7.4e-06 ] [ 4.5e-06 1.46e-05 -5.4e-06 ] [ -5.95e-05 3.93e-05 -2.4e-05 ] [ -4e-06 7.8e-06 1.26e-05 ] [ 2.9e-05 -3.52e-05 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68228545184e-14 -9.260580868224001e-14 4.582225135488e-14 ] [ 1.089480102144e-13 -4.229746278912e-14 -9.6130597248e-15 ] [ -4.4059857072e-14 9.260580868224001e-14 1.185610699392e-14 ] [ 7.2097947936e-15 2.339177866368e-14 -8.65175375232e-15 ] [ -9.532950893760001e-14 6.296554119743999e-14 -3.84522388992e-14 ] [ -6.4087064832e-15 1.249697764224e-14 2.018742542208e-14 ] [ 4.64631220032e-14 -5.639661705216e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }