{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4995834 -8.9956266 2.4188205 ] [ -2.3549725 0.4855502 -5.050136 ] [ -1.0299389 0.9161775 3.4468994 ] [ 5.1356121 8.704675 -1.0307259 ] [ 0.7843974 -0.9528368 1.5213223 ] [ -0.4857184 1.6437015 -1.3811174 ] [ 1.4502036 -1.8016409 0.0749371 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.606950706019776e-09 -1.441258262796659e-08 3.875377655011766e-09 ] [ -3.773081882126928e-09 7.779371786647642e-10 -8.091209831060429e-09 ] [ -1.650144026432469e-09 1.467878171002992e-09 5.522541632929548e-09 ] [ 8.228157640117591e-09 1.394642677666224e-08 -1.651404939433039e-09 ] [ 1.256743175696306e-09 -1.526612844397885e-09 2.437427021761684e-09 ] [ -7.782066647723827e-10 2.633500114873891e-09 -2.212794008860081e-09 ] [ 2.323482303319995e-09 -2.886546929057071e-09 1.200624696505517e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.691374 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.834470581262898e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7602966 0.4776415 2.2808786 ] [ 1.2706602 2.3416306 2.6222309 ] [ 1.5486836 2.7082585 4.8934515 ] [ 3.51051 2.7371127 1.8243179 ] [ 3.1464739 0.9868917 5.4356409 ] [ 4.6460354 1.4067916 3.5421772 ] [ 3.8966884 3.2463602 4.9790779 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7602966e-10 4.776415e-11 2.2808786e-10 ] [ 1.2706602e-10 2.3416306e-10 2.6222309e-10 ] [ 1.5486836e-10 2.7082585e-10 4.893451500000001e-10 ] [ 3.51051e-10 2.7371127e-10 1.8243179e-10 ] [ 3.146473900000001e-10 9.868917000000001e-11 5.435640900000001e-10 ] [ 4.6460354e-10 1.4067916e-10 3.5421772e-10 ] [ 3.8966884e-10 3.2463602e-10 4.979077900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.4e-06 -2.29e-05 -1.66e-05 ] [ -1.6e-06 1.42e-05 2.92e-05 ] [ -1.35e-05 7e-06 4.8e-06 ] [ 1.38e-05 -2e-07 -1.67e-05 ] [ -6.1e-06 -1.26e-05 6.1e-06 ] [ 2.5e-06 1.17e-05 3.4e-06 ] [ -2.4e-06 2.7e-06 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.185610699392e-14 -3.668984461632e-14 -2.659613190528e-14 ] [ -2.56348259328e-15 2.275090801536e-14 4.678355732736e-14 ] [ -2.16293843808e-14 1.12152363456e-14 7.69044777984e-15 ] [ 2.211003736704e-14 -3.2043532416e-16 -2.675634956736e-14 ] [ -9.77327738688e-15 -2.018742542208e-14 9.77327738688e-15 ] [ 4.005441552e-15 1.874546646336e-14 5.44740051072e-15 ] [ -3.84522388992e-15 4.32587687616e-15 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.076362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.376805444791753e-18 } }