{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.4291348 10.1690018 -20.7723001 ] [ -105.873804 -71.5566496 95.6351624 ] [ 72.9641704 -72.7583787 76.9515008 ] [ -195.8837591 293.8160654 -278.6014128 ] [ 251.2225274 -159.670039 126.7870497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.593543540133169e-08 1.629253694083312e-08 -3.32808935804615e-08 ] [ -1.696285335239615e-07 -1.146463910518977e-07 1.532244213236912e-07 ] [ 1.169014879709474e-07 -1.165717733204527e-07 1.232898955172325e-07 ] [ -3.138403792244392e-07 4.707452307993239e-07 -4.463686701100099e-07 ] [ 4.025028600185674e-07 -2.558196035280242e-07 2.031352468495476e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 158.54642 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.540193674355376e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.0143623 0.9920288 0.4635725 ] [ 1.0280542 1.1717456 3.1735971 ] [ 2.6423766 -0.1559271 0.1684429 ] [ 1.6588784 3.3670633 0.3131141 ] [ 3.5672339 1.9298939 1.9732039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.43623e-12 9.920288000000001e-11 4.635725e-11 ] [ 1.0280542e-10 1.1717456e-10 3.1735971e-10 ] [ 2.6423766e-10 -1.559271e-11 1.684429e-11 ] [ 1.6588784e-10 3.3670633e-10 3.131141e-11 ] [ 3.5672339e-10 1.9298939e-10 1.9732039e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -4.5e-06 2.5e-06 ] [ -1.1e-06 3e-07 4.8e-06 ] [ 7.1e-06 -4.4e-06 5e-07 ] [ 1.05e-05 9.2e-06 4.6e-06 ] [ -1.56e-05 -6e-07 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.44195895872e-15 -7.2097947936e-15 4.005441552e-15 ] [ -1.76239428288e-15 4.8065298624e-16 7.69044777984e-15 ] [ 1.137545400768e-14 -7.04957713152e-15 8.010883104e-16 ] [ 1.68228545184e-14 1.474002491136e-14 7.370012455680001e-15 ] [ -2.499395528448e-14 -9.6130597248e-16 -1.986699009792e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }