{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.23605 0.7845255 -0.8200824 ] [ 0.4249334 -0.3832816 0.1053035 ] [ -0.1022708 1.6608221 0.9395327 ] [ 0.198319 -0.9249279 -0.5417697 ] [ 0.2083892 -0.0127198 -1.0799447 ] [ -0.8312196 -0.9062618 0.448165 ] [ 0.3378988 -0.2181566 0.9487956 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.781937944557e-10 1.256948424877167e-09 -1.313916859234641e-09 ] [ 6.808183644861756e-10 -6.140848237621343e-10 1.68714807178419e-10 ] [ -1.638558861004872e-10 2.660930361850811e-09 1.505297338818932e-09 ] [ 3.17742067878246e-10 -1.481897869514688e-09 -8.680107543491897e-10 ] [ 3.338763070179528e-10 -2.03793663491532e-11 -1.73026216435214e-09 ] [ -1.331760620842826e-09 -1.451991480246781e-09 7.180394911766099e-10 ] [ 5.413735620166391e-10 -3.495254070728844e-10 1.52013814076201e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.975881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.200488978176455e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8900041 3.8211365 2.9875288 ] [ 5.5248899 2.4242596 1.2044098 ] [ 3.550925 1.0909982 1.1128044 ] [ 3.1396506 1.4872974 3.4039127 ] [ 5.1027394 2.8310411 3.5560154 ] [ 4.8990425 4.5935158 1.9656977 ] [ 3.3121534 3.4143718 0.6359182 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8900041e-10 3.8211365e-10 2.9875288e-10 ] [ 5.5248899e-10 2.4242596e-10 1.2044098e-10 ] [ 3.550925e-10 1.0909982e-10 1.1128044e-10 ] [ 3.1396506e-10 1.4872974e-10 3.4039127e-10 ] [ 5.1027394e-10 2.8310411e-10 3.5560154e-10 ] [ 4.8990425e-10 4.5935158e-10 1.9656977e-10 ] [ 3.3121534e-10 3.4143718e-10 6.359182e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.83e-05 4.02e-05 2.06e-05 ] [ 1.98e-05 -1.36e-05 -3.8e-05 ] [ 1.85e-05 -2.05e-05 -6e-07 ] [ -2.12e-05 -5.2e-06 -5.2e-06 ] [ 3.3e-06 -4.7e-06 -2e-07 ] [ -5.2e-06 1.41e-05 8.4e-06 ] [ 3.2e-06 -1.02e-05 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.93198324022e-14 6.44075006868e-14 3.300483866039999e-14 ] [ 3.17230973532e-14 -2.17896022224e-14 -6.088271209199999e-14 ] [ 2.9640267729e-14 -3.2844620997e-14 -9.613059803999998e-16 ] [ -3.39661446408e-14 -8.331318496799998e-15 -8.331318496799998e-15 ] [ 5.2871828922e-15 -7.530230179799999e-15 -3.204353268e-16 ] [ -8.331318496799998e-15 2.25906905394e-14 1.34582837256e-14 ] [ 5.1269652288e-15 -1.63422016668e-14 2.41928671734e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }