{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5626961 -5.3000082 -2.5619632 ] [ -2.6451094 2.1315755 3.5137752 ] [ -0.7086297 4.5617992 -3.8571325 ] [ 1.6028428 -0.5287762 -2.3705293 ] [ 2.9646311 -4.7241437 3.4684835 ] [ -0.1502832 -0.446067 -1.4424805 ] [ -0.5007554 4.3056204 3.2498467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.015385360353389e-10 -8.49154922808829e-09 -4.104717542389955e-09 ] [ -4.237932440138315e-09 3.41516043157007e-09 5.629688476186845e-09 ] [ -1.135349938144518e-09 7.308808027024144e-09 -6.179807514827856e-09 ] [ 2.56803726097761e-09 -8.471928652754651e-10 -3.798006623381389e-09 ] [ 4.749862637716587e-09 -7.568912589439609e-09 5.557123173330557e-09 ] [ -2.407802295390106e-10 -7.146781187103936e-10 -2.311108533059895e-09 ] [ -8.022985946193522e-10 6.898364342919544e-09 5.206828403924031e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.434972 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.312737466030262e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5081662 1.5663324 2.0057295 ] [ 2.0399208 2.846135 4.1641825 ] [ 2.0071358 4.0213981 1.9018019 ] [ 4.8653729 2.1757251 2.3504125 ] [ 4.4167181 2.1503473 4.7703255 ] [ 4.3664988 4.5703933 2.3376133 ] [ 3.8188775 4.5856157 4.7347958 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5081662e-10 1.5663324e-10 2.0057295e-10 ] [ 2.0399208e-10 2.846135e-10 4.1641825e-10 ] [ 2.0071358e-10 4.0213981e-10 1.9018019e-10 ] [ 4.8653729e-10 2.1757251e-10 2.3504125e-10 ] [ 4.4167181e-10 2.1503473e-10 4.7703255e-10 ] [ 4.3664988e-10 4.5703933e-10 2.3376133e-10 ] [ 3.8188775e-10 4.5856157e-10 4.7347958e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.09e-05 -3.03e-05 -7.1e-06 ] [ 2.64e-05 2.2e-06 2.41e-05 ] [ 8.1e-06 -1.9e-06 -4.8e-06 ] [ -1.12e-05 3.89e-05 -3.23e-05 ] [ -5.79e-05 1.51e-05 1.92e-05 ] [ 5.3e-06 -7.8e-06 -1.54e-05 ] [ 1.85e-05 -1.6e-05 1.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.746372516672e-14 -4.854595161024e-14 -1.137545400768e-14 ] [ 4.229746278912e-14 3.52478856576e-15 3.861245656128e-14 ] [ 1.297763062848e-14 -3.04413557952e-15 -7.69044777984e-15 ] [ -1.794437815296e-14 6.232467054911999e-14 -5.175030485184e-14 ] [ -9.276602634432e-14 2.419286697408e-14 3.076179111936e-14 ] [ 8.491536090240001e-15 -1.249697764224e-14 -2.467351996032e-14 ] [ 2.96402674848e-14 -2.56348259328e-14 2.611547891904e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.30807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.933276172596986e-18 } }