{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.8617056 -28.3653962 -34.5872422 ] [ -21.870452 -11.8266773 16.5144451 ] [ -6.6247885 37.2276558 35.0188181 ] [ 32.6031074 -24.4599886 3.4661858 ] [ 15.7538386 27.4244064 -20.4122069 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.182196036153244e-08 -4.544637463136916e-08 -5.541487083078715e-08 ] [ -3.50403268807286e-08 -1.894842587180607e-08 2.645905784470512e-08 ] [ -1.06140812524447e-08 5.964527976994953e-08 5.610633164786788e-08 ] [ 5.223593644171147e-08 -3.918922187995452e-08 5.553441852108945e-09 ] [ 2.524043189277661e-08 4.39387427733979e-08 -3.270396067411245e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 33.063994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.297435817707148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8472942 -0.1925419 1.3876967 ] [ -0.3171802 1.1218873 2.9524379 ] [ 0.8641321 3.1364861 3.2317708 ] [ 2.748632 1.0094261 0.7004455 ] [ 2.7587112 3.0671324 1.8396906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.472942e-11 -1.925419e-11 1.3876967e-10 ] [ -3.171802e-11 1.1218873e-10 2.9524379e-10 ] [ 8.641321e-11 3.1364861e-10 3.2317708e-10 ] [ 2.748632e-10 1.0094261e-10 7.004455000000001e-11 ] [ 2.7587112e-10 3.0671324e-10 1.8396906e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.7e-06 -6.8e-06 4.76e-05 ] [ 1.42e-05 6.3e-06 -2.92e-05 ] [ -1.55e-05 -1.56e-05 -1.65e-05 ] [ -3.39e-05 4.24e-05 -1.93e-05 ] [ 2.96e-05 -2.63e-05 1.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.13240673856e-15 -1.089480102144e-14 7.626360715008e-14 ] [ 2.275090801536e-14 1.009371271104e-14 -4.678355732736e-14 ] [ -2.48337376224e-14 -2.499395528448e-14 -2.64359142432e-14 ] [ -5.431378744512e-14 6.793228872192001e-14 -3.092200878144e-14 ] [ 4.742442797568e-14 -4.213724512704e-14 2.771765553984e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }