{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.600247 1.761403 2.21582 ] [ 1.350999 3.710266 1.758192 ] [ 4.508932 5.134782 2.974852 ] [ 3.702352 3.46043 0.9070332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.600247e-10 1.761403e-10 2.21582e-10 ] [ 1.350999e-10 3.710266e-10 1.758192e-10 ] [ 4.508932e-10 5.134782e-10 2.974852e-10 ] [ 3.702352e-10 3.46043e-10 9.070332e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0257501 -3.4036635 1.4502405 ] [ -1.9150649 2.5192605 -0.5247343 ] [ -0.4750576 -1.0466 -1.1225016 ] [ 1.3643724 1.931003 0.1969954 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.643432829003262e-09 -5.453270084770301e-09 2.323541423637303e-09 ] [ -3.06827221009469e-09 4.036300274804919e-09 -8.407170275918535e-10 ] [ -7.611261802533581e-10 -1.67683805132928e-09 -1.798445820330594e-09 ] [ 2.185965561344786e-09 3.093807861294662e-09 3.156214242851443e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7154751 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.236155382358454e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1924835 1.4496501 2.39592 ] [ 1.134186 4.2895568 1.4633725 ] [ 4.436963 4.8258796 2.8688392 ] [ 3.3988975 3.5017944 1.1277654 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1924835e-10 1.4496501e-10 2.39592e-10 ] [ 1.134186e-10 4.2895568e-10 1.4633725e-10 ] [ 4.436963e-10 4.825879600000001e-10 2.8688392e-10 ] [ 3.3988975e-10 3.5017944e-10 1.1277654e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 1e-06 ] [ 2.5e-06 1e-07 1.3e-06 ] [ -2.2e-06 -6e-07 1e-07 ] [ -3e-07 5e-07 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 1.6021766208e-15 ] [ 4.005441552e-15 1.6021766208e-16 2.08282960704e-15 ] [ -3.52478856576e-15 -9.6130597248e-16 1.6021766208e-16 ] [ -4.8065298624e-16 8.010883104e-16 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.1265651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.462236923142922e-18 } }