{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.8072946e-10 1.3986578e-10 2.4593446e-10 ] [ 2.613459e-10 1.5719598e-10 5.053742400000001e-10 ] [ 1.2656807e-10 4.0537027e-10 2.7218495e-10 ] [ 4.2958336e-10 1.913072e-10 1.568905e-10 ] [ 5.249506600000001e-10 2.1151097e-10 4.1107692e-10 ] [ 3.9006552e-10 4.5984764e-10 1.7772469e-10 ] [ 3.4410703e-10 4.3489637e-10 4.6551494e-10 ] ] "source-value" [ [ 1.8072946 1.3986578 2.4593446 ] [ 2.613459 1.5719598 5.0537424 ] [ 1.2656807 4.0537027 2.7218495 ] [ 4.2958336 1.913072 1.568905 ] [ 5.2495066 2.1151097 4.1107692 ] [ 3.9006552 4.5984764 1.7772469 ] [ 3.4410703 4.3489637 4.6551494 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.277735855088e-12 -2.06296261694208e-12 -2.2526603288448e-12 ] [ 6.81790239215232e-12 -1.0109734477248e-13 3.12728854613952e-12 ] [ 3.43282362772608e-12 4.07481579968064e-12 -2.22045657876672e-12 ] [ -5.070889004832e-13 -1.76928364234944e-12 -2.08427156599872e-12 ] [ -5.21860968926976e-12 1.39084952451648e-12 2.7829807903296e-12 ] [ -2.53896929098176e-12 1.0646463645216e-12 3.1010128495584e-12 ] [ -7.083222840556801e-13 -2.59696808465472e-12 -2.45389371241728e-12 ] ] "source-value" [ [ -0.0007975 -0.0012876 -0.001406 ] [ 0.0042554 -6.31e-05 0.0019519 ] [ 0.0021426 0.0025433 -0.0013859 ] [ -0.0003165 -0.0011043 -0.0013009 ] [ -0.0032572 0.0008681 0.001737 ] [ -0.0015847 0.0006645 0.0019355 ] [ -0.0004421 -0.0016209 -0.0015316 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.143336748261763e-18 "source-value" -19.619165 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.8410877701298e-09 -5.032709937046647e-09 -1.684197136940406e-08 ] [ 3.596366927817875e-09 -1.693940117167387e-08 4.769055544044838e-08 ] [ -5.134239324766692e-08 3.523469493748096e-09 -2.613231923728357e-08 ] [ -5.861700473733203e-09 5.55602119625077e-09 -7.681589954130713e-08 ] [ 1.776355874258378e-08 -8.353143598523861e-09 5.147008688456234e-08 ] [ 1.847567898631907e-08 4.391154678656579e-09 -2.822452830669706e-08 ] [ 2.620957667459153e-08 1.685460901815361e-08 4.885407612968109e-08 ] ] "source-value" [ [ -5.518173 -3.1411705 -10.5119318 ] [ 2.2446757 -10.5727427 29.7661037 ] [ -32.0454016 2.1991767 -16.3105109 ] [ -3.6585857 3.4677957 -47.9447138 ] [ 11.0871414 -5.2136222 32.1251017 ] [ 11.5316119 2.7407432 -17.6163651 ] [ 16.3587312 10.5198196 30.4923162 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.51620379128434e-18 "source-value" 9.4633998 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] "source-value" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] } "instance-id" 1 }