{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1466045 -1.5666855 0.563623 ] [ -1.5835274 -1.3724905 -0.9206885 ] [ -2.6565604 1.3776026 1.3699531 ] [ 0.1965955 0.974505 0.5873544 ] [ -0.2288048 0.5141203 -0.9168499 ] [ 2.6265245 -1.2686207 1.041402 ] [ 0.4991681 1.3415688 -1.7247941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.837062923204074e-09 -2.510106880246359e-09 9.030235935451583e-10 ] [ -2.53709057867621e-09 -2.198972191370103e-09 -1.475105589739421e-09 ] [ -4.256278964623096e-09 2.207162678473294e-09 2.194906828412484e-09 ] [ 3.149807138544864e-10 1.561329127852704e-09 9.410454878040116e-10 ] [ -3.665857012868199e-10 8.237115249386821e-10 -1.468955474562818e-09 ] [ 4.208156147858409e-09 -2.03255442620293e-09 1.668509937254362e-09 ] [ 7.997554596691566e-10 2.149430166554711e-09 -2.763424782713777e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.180808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.713974862885361e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6623416 1.3004801 2.0016214 ] [ 2.4543758 0.4032199 4.0577513 ] [ 2.3953496 2.6268165 5.007274 ] [ 1.6052561 3.4561822 2.9221013 ] [ 4.0328888 1.2409268 2.1941622 ] [ 4.5302921 1.563799 4.5492076 ] [ 3.973981 3.4645344 3.1436743 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6623416e-10 1.3004801e-10 2.0016214e-10 ] [ 2.4543758e-10 4.032199e-11 4.0577513e-10 ] [ 2.3953496e-10 2.6268165e-10 5.007274e-10 ] [ 1.6052561e-10 3.4561822e-10 2.9221013e-10 ] [ 4.0328888e-10 1.2409268e-10 2.1941622e-10 ] [ 4.5302921e-10 1.563799e-10 4.5492076e-10 ] [ 3.973981000000001e-10 3.4645344e-10 3.1436743e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.27e-05 3.69e-05 -2.37e-05 ] [ 3.59e-05 5.02e-05 3.04e-05 ] [ 2.06e-05 1.03e-05 3.02e-05 ] [ -4.83e-05 -2.56e-05 -1.47e-05 ] [ 7e-06 8.6e-06 6.1e-06 ] [ -4.45e-05 -2.1e-05 -3.76e-05 ] [ -3.4e-06 -5.95e-05 9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.239117550016001e-14 5.912031730752001e-14 -3.797158591296e-14 ] [ 5.751814068672e-14 8.042926636416e-14 4.870616927232e-14 ] [ 3.300483838848e-14 1.650241919424e-14 4.838573394816e-14 ] [ -7.738513078464e-14 -4.101572149248001e-14 -2.355199632576e-14 ] [ 1.12152363456e-14 1.377871893888e-14 9.77327738688e-15 ] [ -7.129685962560001e-14 -3.36457090368e-14 -6.024184094208e-14 ] [ -5.44740051072e-15 -9.532950893760001e-14 1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }