{ "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" [ [ 2.058884 2.441785 3.519822 ] [ 1.92668 3.148467 1.175123 ] [ 5.519963 2.275692 0.7370638 ] [ 3.694005 1.670931 2.395445 ] [ 3.953137 3.917443 1.57665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.058884e-10 2.441785e-10 3.519822e-10 ] [ 1.92668e-10 3.148467e-10 1.175123e-10 ] [ 5.519963e-10 2.275692e-10 7.370638000000001e-11 ] [ 3.694005e-10 1.670931e-10 2.395445e-10 ] [ 3.953137e-10 3.917443e-10 1.57665e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0813827 2.547599 -0.6112688 ] [ -0.6623342 -2.020662 1.2852756 ] [ -1.2274856 0.4670934 0.8620717 ] [ 1.8695956 0.3110953 -3.1720112 ] [ 1.1016069 -1.3051257 1.6359326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.73256608007758e-09 4.081703556973459e-09 -9.79360580384471e-10 ] [ -1.061176370396271e-09 -3.23745741493897e-09 2.059238517604693e-09 ] [ -1.96664873068866e-09 7.483661252099828e-10 1.381191123193311e-09 ] [ 2.995422360670549e-09 4.984296165007623e-10 -5.082122185555753e-09 ] [ 1.764968820491963e-09 -2.091041883745235e-09 2.621052964924558e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.40579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.628497318375443e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3283726 2.8908962 3.4278612 ] [ 1.9779232 2.8178361 1.0870793 ] [ 5.3508691 2.421931 0.8350803 ] [ 3.6134994 1.4818126 2.0839723 ] [ 3.8820047 3.8418422 1.9701107 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3283726e-10 2.8908962e-10 3.4278612e-10 ] [ 1.9779232e-10 2.8178361e-10 1.0870793e-10 ] [ 5.350869099999999e-10 2.421931e-10 8.350803e-11 ] [ 3.6134994e-10 1.4818126e-10 2.0839723e-10 ] [ 3.8820047e-10 3.8418422e-10 1.9701107e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 4.5e-06 1.9e-05 ] [ -3.04e-05 -1.8e-06 -1.4e-06 ] [ 2.74e-05 -6.7e-06 9.7e-06 ] [ 2.9e-06 -3.8e-06 -1.94e-05 ] [ 2.4e-06 7.8e-06 -7.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 7.2097947936e-15 3.04413557952e-14 ] [ -4.870616927232e-14 -2.88391791744e-15 -2.24304726912e-15 ] [ 4.389963940992e-14 -1.073458335936e-14 1.554111322176e-14 ] [ 4.646312200320001e-15 -6.08827115904e-15 -3.108222644352e-14 ] [ 3.84522388992e-15 1.249697764224e-14 -1.265719530432e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.979559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040860570289423e-18 } }