{ "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" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1661708 -0.2249561 -1.3988826 ] [ 1.9878714 -0.9091058 -1.7510704 ] [ -0.6561432 0.2519231 0.3751573 ] [ 0.0287708 -0.0797749 -0.1680238 ] [ -1.1943281 0.9619137 2.9428195 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.662349708196327e-10 -3.604194041263468e-10 -2.241256996963918e-09 ] [ 3.184921082236965e-09 -1.456548058593681e-09 -2.805524056254905e-09 ] [ -1.051257294936899e-09 4.036253010594605e-10 6.010682551824518e-10 ] [ 4.609590312171264e-11 -1.278134797066579e-10 -2.692038040979751e-10 ] [ -1.913524559384484e-09 1.541155641367225e-09 4.714916602134346e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.420286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.150166847364955e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3637691 3.252066 2.3409197 ] [ 5.5979815 2.4657716 2.0797831 ] [ 3.75784 2.4760379 0.6009049 ] [ 3.6073436 1.1719978 2.6633704 ] [ 4.2038877 3.2417183 3.8198179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3637691e-10 3.252066e-10 2.3409197e-10 ] [ 5.597981500000001e-10 2.4657716e-10 2.0797831e-10 ] [ 3.75784e-10 2.4760379e-10 6.009049e-11 ] [ 3.6073436e-10 1.1719978e-10 2.6633704e-10 ] [ 4.2038877e-10 3.2417183e-10 3.8198179e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 -1.96e-05 -6.7e-06 ] [ 7.6e-06 -8.1e-06 9e-06 ] [ -6e-07 2.04e-05 -1.35e-05 ] [ -1.15e-05 -4.4e-06 1.01e-05 ] [ 2e-05 1.17e-05 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48337376224e-14 -3.140266176767999e-14 -1.073458335936e-14 ] [ 1.217654231808e-14 -1.297763062848e-14 1.44195895872e-14 ] [ -9.6130597248e-16 3.268440306432e-14 -2.16293843808e-14 ] [ -1.84250311392e-14 -7.04957713152e-15 1.618198387008e-14 ] [ 3.2043532416e-14 1.874546646336e-14 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }