{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.536382 -2.8566738 0.1156447 ] [ -1.2167351 2.8707307 -3.1077286 ] [ -3.4237864 -0.3692428 1.6949823 ] [ 1.0062427 -1.8834134 -1.0733429 ] [ 0.0006188 -2.6548217 -1.5696022 ] [ 1.8922963 5.1038832 0.3223259 ] [ 2.2777458 -0.2104622 3.6177207 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.593787002179456e-10 -4.576895975611895e-09 1.852832346594298e-10 ] [ -1.94942453092675e-09 4.599417612152819e-09 -4.979130106711516e-09 ] [ -5.485510524692997e-09 -5.915921815587303e-10 2.715661013729812e-09 ] [ 1.612178528790668e-09 -3.017560916781439e-09 -1.719684900481673e-09 ] [ 9.914268929510398e-13 -4.253493260132511e-09 -2.514779948796246e-09 ] [ 3.031792891486343e-09 8.177322338333892e-09 5.164230212583187e-10 ] [ 3.649351068885393e-09 -3.371976164021338e-10 5.796227526124211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.848767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.379034733510656e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3934347 2.3230262 1.9423889 ] [ 2.8744045 4.5386822 0.8445323 ] [ 2.3955745 3.7451877 4.0417799 ] [ 5.7215217 3.0743905 1.4867356 ] [ 4.5124331 1.3803508 2.8303517 ] [ 4.4601479 4.8092497 2.8313974 ] [ 4.7085346 3.0244989 4.7011102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3934347e-10 2.3230262e-10 1.9423889e-10 ] [ 2.8744045e-10 4.5386822e-10 8.445323000000001e-11 ] [ 2.3955745e-10 3.7451877e-10 4.0417799e-10 ] [ 5.721521700000001e-10 3.0743905e-10 1.4867356e-10 ] [ 4.5124331e-10 1.3803508e-10 2.8303517e-10 ] [ 4.4601479e-10 4.809249699999999e-10 2.8313974e-10 ] [ 4.7085346e-10 3.024498900000001e-10 4.701110199999999e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.5e-06 -7.3e-06 1.35e-05 ] [ -7e-06 1.93e-05 -1.53e-05 ] [ 8e-07 -2.9e-06 3.4e-06 ] [ 1.32e-05 1e-06 7.8e-06 ] [ 1e-06 -6.9e-06 -2.8e-06 ] [ -9e-07 -2.4e-06 -7.2e-06 ] [ -1.6e-06 -7e-07 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.8119714144e-15 -1.169588933184e-14 2.16293843808e-14 ] [ -1.12152363456e-14 3.092200878144e-14 -2.451330229824e-14 ] [ 1.28174129664e-15 -4.646312200320001e-15 5.44740051072e-15 ] [ 2.114873139456e-14 1.6021766208e-15 1.249697764224e-14 ] [ 1.6021766208e-15 -1.105501868352e-14 -4.48609453824e-15 ] [ -1.44195895872e-15 -3.84522388992e-15 -1.153567166976e-14 ] [ -2.56348259328e-15 -1.12152363456e-15 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.989616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.882254217236962e-18 } }