{ "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" [ [ 2.625679 2.727046 1.588106 ] [ 1.116882 2.069952 3.236218 ] [ 3.070568 3.395161 4.858531 ] [ 1.593326 4.342716 3.66284 ] [ 4.916804 2.207526 1.823276 ] [ 3.525085 1.533636 3.413768 ] [ 3.625469 4.392152 2.422621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.625679e-10 2.727046e-10 1.588106e-10 ] [ 1.116882e-10 2.069952e-10 3.236218e-10 ] [ 3.070568e-10 3.395161e-10 4.858531e-10 ] [ 1.593326e-10 4.342716e-10 3.66284e-10 ] [ 4.916804e-10 2.207526e-10 1.823276e-10 ] [ 3.525085e-10 1.533636e-10 3.413768e-10 ] [ 3.625469e-10 4.392152e-10 2.422621e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4763996 -1.4971593 -4.592031 ] [ 0.0089743 -0.6636506 1.5430333 ] [ 1.4115245 -0.6677769 1.5503489 ] [ -2.6507954 2.2793587 -1.550195 ] [ 0.2967781 1.3214421 -0.2680194 ] [ 0.4466302 -2.9355742 1.739129 ] [ 2.9632879 2.1633602 1.5777342 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.967629542878472e-09 -2.398713628073294e-09 -7.357244710188846e-09 ] [ 1.437841364804544e-11 -1.063285475699893e-09 2.472211878375873e-09 ] [ 2.26151155358641e-09 -1.069896537090299e-09 2.483932761662997e-09 ] [ -4.247042416404185e-09 3.651935219557081e-09 -2.483686186681056e-09 ] [ 4.754909333854445e-10 2.117183638360856e-09 -4.294144166008436e-10 ] [ 7.155804645832282e-10 -4.703308351863663e-09 2.786391824355283e-09 ] [ 4.747710594079529e-09 3.466085134809212e-09 2.527808849076592e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.527881 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.730888059996453e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3993965 2.6914839 1.4423246 ] [ 1.3391655 2.0709806 3.5851236 ] [ 3.0530954 3.3218314 4.842043 ] [ 1.6184659 4.336154 3.1114258 ] [ 4.6876538 2.4886716 1.8217112 ] [ 3.4838451 1.2236465 3.4476518 ] [ 3.8921907 4.5354209 2.75508 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3993965e-10 2.6914839e-10 1.4423246e-10 ] [ 1.3391655e-10 2.0709806e-10 3.585123600000001e-10 ] [ 3.0530954e-10 3.3218314e-10 4.842043000000001e-10 ] [ 1.6184659e-10 4.336154e-10 3.1114258e-10 ] [ 4.6876538e-10 2.4886716e-10 1.8217112e-10 ] [ 3.4838451e-10 1.2236465e-10 3.4476518e-10 ] [ 3.8921907e-10 4.5354209e-10 2.75508e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 -2.66e-05 -6.96e-05 ] [ -2.04e-05 -2.38e-05 -1.88e-05 ] [ 2.14e-05 4.68e-05 8.01e-05 ] [ -1.99e-05 8.4e-06 -1.7e-06 ] [ -2.03e-05 -1.17e-05 -3.22e-05 ] [ 1.17e-05 -3.15e-05 1.17e-05 ] [ 3.54e-05 3.83e-05 3.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 -4.261789811328e-14 -1.1151149280768e-13 ] [ -3.268440306432e-14 -3.813180357504e-14 -3.012092047104e-14 ] [ 3.428657968511999e-14 7.498186585344001e-14 1.2833434732608e-13 ] [ -3.188331475392e-14 1.345828361472e-14 -2.72370025536e-15 ] [ -3.252418540224e-14 -1.874546646336e-14 -5.159008718975999e-14 ] [ 1.874546646336e-14 -5.04685635552e-14 1.874546646336e-14 ] [ 5.671705237632e-14 6.136336457664001e-14 4.88663869344e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }