{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.9935818 -6.2119267 -4.5629597 ] [ -202.0400215 -38.1497738 116.3918276 ] [ 4.5781353 -44.7068322 97.0681418 ] [ 6.6449649 12.4158244 3.9568437 ] [ 203.810503 76.6527084 -212.8538533 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.081801298041238e-08 -9.952603728863295e-09 -7.310667352992582e-09 ] [ -3.237037989132293e-07 -6.112267567116838e-08 1.864802650329042e-07 ] [ 7.334981344519193e-09 -7.162824134086864e-08 1.555203074164592e-07 ] [ 1.064640740881661e-08 1.989234358163819e-08 6.339562468299769e-09 ] [ 3.265404229800883e-07 1.228111773194798e-07 -3.410294674044529e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 21.79346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.491697209833997e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1938122 0.4606027 0.9514375 ] [ 0.6512121 2.5604759 1.4401872 ] [ 0.8840417 1.0667954 3.0596077 ] [ 2.6685096 1.7838548 1.9599169 ] [ 2.1249798 2.1364883 -0.1585825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1938122e-10 4.606027e-11 9.514375000000001e-11 ] [ 6.512121e-11 2.5604759e-10 1.4401872e-10 ] [ 8.840417e-11 1.0667954e-10 3.0596077e-10 ] [ 2.6685096e-10 1.7838548e-10 1.9599169e-10 ] [ 2.1249798e-10 2.1364883e-10 -1.585825e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.99e-05 -9.34e-05 -4.95e-05 ] [ -7.41e-05 6.28e-05 -8.55e-05 ] [ 4.21e-05 3.22e-05 2.76e-05 ] [ 8.5e-05 -5.07e-05 6.84e-05 ] [ -3.31e-05 4.9e-05 3.9e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.188331475392e-14 -1.4964329638272e-13 -7.930774272959999e-14 ] [ -1.1872128760128e-13 1.0061669178624e-13 -1.369861010784e-13 ] [ 6.745163573568001e-14 5.159008718975999e-14 4.422007473408001e-14 ] [ 1.36185012768e-13 -8.123035467456e-14 1.0958888086272e-13 ] [ -5.303204614848e-14 7.85066544192e-14 6.248488821120001e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }