{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0992293 -14.3850117 -30.2674603 ] [ 10.4878513 -14.1492165 30.2657703 ] [ -17.2814758 -6.6094736 0.4996961 ] [ -15.931484 27.7543235 3.7653223 ] [ 22.8243377 7.3893782 -4.2633285 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.589828645583495e-10 -2.304732943567446e-08 -4.849381726365216e-08 ] [ 1.680339015528689e-08 -2.26695438789376e-08 4.8491109585163e-08 ] [ -2.768797649968097e-08 -1.058954407771481e-08 8.006014089249388e-10 ] [ -2.552505119944926e-08 4.446732823782003e-08 6.032711358836884e-09 ] [ 3.656862024818405e-08 1.183908899428919e-08 -6.830605249490333e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 14.789589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.369553372704085e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0917806 2.0377582 1.6465845 ] [ 2.5825025 1.9901984 5.0303921 ] [ 0.4226483 2.2560894 3.6195343 ] [ 1.1843755 4.734049 3.5439025 ] [ 3.4831274 3.585222 3.1943826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0917806e-10 2.0377582e-10 1.6465845e-10 ] [ 2.5825025e-10 1.9901984e-10 5.0303921e-10 ] [ 4.226483e-11 2.2560894e-10 3.619534300000001e-10 ] [ 1.1843755e-10 4.734048999999999e-10 3.5439025e-10 ] [ 3.4831274e-10 3.585222e-10 3.1943826e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.2e-06 5.3e-06 3.91e-05 ] [ 6.8e-06 -3.81e-05 -0.0 ] [ 2.18e-05 2.94e-05 -1.16e-05 ] [ 3.7e-06 -1.69e-05 -2.31e-05 ] [ -2.5e-05 2.02e-05 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.153567166976e-14 8.491536090240001e-15 6.264510587328001e-14 ] [ 1.089480102144e-14 -6.104292925248e-14 0.0 ] [ 3.492745033344e-14 4.710399265152e-14 -1.858524880128e-14 ] [ 5.928053496960001e-15 -2.707678489152e-14 -3.701027994048e-14 ] [ -4.005441552e-14 3.236396774016e-14 -7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }