{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.744142 -2.9380242 2.5009449 ] [ 1.9539065 -1.2101011 -1.7911197 ] [ 0.4055594 3.453985 0.1479752 ] [ 1.5947302 1.1018094 0.4641071 ] [ -1.2100541 -0.4076691 -1.3219075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.396600192778027e-09 -4.707233723366542e-09 4.006955481701466e-09 ] [ 3.13050333932072e-09 -1.938795707197697e-09 -2.86969013203709e-09 ] [ 6.497777943790595e-10 5.53389406118649e-09 2.370824078514768e-10 ] [ 2.555039463974147e-09 1.76529327580156e-09 7.435815512935013e-10 ] [ -1.938720404895899e-09 -6.531579064238093e-10 -2.117929308809355e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.908572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907963580270665e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.021135 1.4873112 1.9256817 ] [ 1.1177176 2.9474416 3.7030377 ] [ 2.3281635 4.0562001 1.8557134 ] [ 4.1621644 2.5166142 1.2447514 ] [ 3.5705231 2.6525829 3.6402938 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.021135e-10 1.4873112e-10 1.9256817e-10 ] [ 1.1177176e-10 2.9474416e-10 3.7030377e-10 ] [ 2.3281635e-10 4.0562001e-10 1.8557134e-10 ] [ 4.1621644e-10 2.5166142e-10 1.2447514e-10 ] [ 3.5705231e-10 2.6525829e-10 3.6402938e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 1.25e-05 6.6e-06 ] [ 7.9e-06 -5.6e-06 -8.7e-06 ] [ 1.82e-05 -1.53e-05 -2.01e-05 ] [ -4.26e-05 2.05e-05 3.72e-05 ] [ 9.4e-06 -1.21e-05 -1.5e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.13754541014e-14 2.0027207925e-14 1.05743657844e-14 ] [ 1.26571954086e-14 -8.972189150399999e-15 -1.39389367158e-14 ] [ 2.915961473879999e-14 -2.45133025002e-14 -3.22037503434e-14 ] [ -6.82527246084e-14 3.2844620997e-14 5.96009707848e-14 ] [ 1.50604603596e-14 -1.93863372714e-14 -2.403264951e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.399219 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.146791559564885e-18 } }