{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8763985 -1.3750385 1.1130961 ] [ -3.2604858 0.71425 1.7703433 ] [ 2.6745616 -4.913253 -3.6558369 ] [ 2.0379148 -0.0274644 6.6104668 ] [ 3.4244079 5.6015059 -5.8380692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.812851670404188e-09 -2.203054537399901e-09 1.783376548123659e-09 ] [ -5.223874121210385e-09 1.1443546514064e-09 2.83640264604992e-09 ] [ 4.285120066409441e-09 -7.871899088675463e-09 -5.857296410637948e-09 ] [ 3.265099447742308e-09 -4.400281958429952e-11 1.059113535953459e-08 ] [ 5.486506277462824e-09 8.974601794253263e-09 -9.353617982852559e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.239666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121228333240065e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.496675 1.767506 2.6131233 ] [ 1.5763209 4.1342526 3.5874508 ] [ 3.873267 1.0500955 1.9852221 ] [ 3.5024763 2.5127398 4.0541122 ] [ 3.1752268 3.4962721 1.6917736 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.496675e-10 1.767506e-10 2.6131233e-10 ] [ 1.5763209e-10 4.1342526e-10 3.5874508e-10 ] [ 3.873267e-10 1.0500955e-10 1.9852221e-10 ] [ 3.5024763e-10 2.5127398e-10 4.0541122e-10 ] [ 3.1752268e-10 3.4962721e-10 1.6917736e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.09e-05 3.6e-06 1.68e-05 ] [ -1.08e-05 -1.14e-05 3.39e-05 ] [ 2.92e-05 -1.4e-05 -3.61e-05 ] [ -2.33e-05 3.99e-05 9.2e-06 ] [ 4.58e-05 -1.82e-05 -2.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.552902379072e-14 5.76783583488e-15 2.691656722944e-14 ] [ -1.730350750464e-14 -1.826481347712e-14 5.431378744512e-14 ] [ 4.678355732736e-14 -2.24304726912e-14 -5.783857601088001e-14 ] [ -3.733071526464e-14 6.392684716992e-14 1.474002491136e-14 ] [ 7.337968923264e-14 -2.915961449856e-14 -3.797158591296e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }