{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1577529e-10 1.9544564e-10 3.2151111e-10 ] [ 2.9451882e-10 5.6709958e-10 2.8434008e-10 ] [ 2.5077139e-10 3.6122167e-10 9.25321e-11 ] [ 4.657370399999999e-10 1.6940159e-10 1.8732474e-10 ] [ 5.6553439e-10 3.2470708e-10 4.0323243e-10 ] [ 5.2968379e-10 4.6590611e-10 1.5878349e-10 ] [ 3.1530957e-10 3.8676743e-10 4.8507336e-10 ] ] "source-value" [ [ 2.1577529 1.9544564 3.2151111 ] [ 2.9451882 5.6709958 2.8434008 ] [ 2.5077139 3.6122167 0.925321 ] [ 4.6573704 1.6940159 1.8732474 ] [ 5.6553439 3.2470708 4.0323243 ] [ 5.2968379 4.6590611 1.5878349 ] [ 3.1530957 3.8676743 4.8507336 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.079851020652992e-10 7.371742806430463e-11 -6.7884223423296e-11 ] [ 9.83303857483584e-11 -1.594221813877728e-10 -9.272933649970369e-11 ] [ -7.778935994606785e-11 1.069589079396768e-10 8.287434810516288e-11 ] [ 1.755633097540224e-11 -1.044016738352179e-10 1.060278831053299e-10 ] [ -7.984895799210624e-11 2.34766940245824e-11 -8.610193290776448e-11 ] [ -7.39452575797824e-11 7.0451711458128e-11 9.716352051542977e-11 ] [ 7.711756728896641e-12 -1.078072604603904e-11 -3.93502588951584e-11 ] ] "source-value" [ [ 0.067399 0.0460108 -0.04237 ] [ 0.061373 -0.0995035 -0.0578771 ] [ -0.0485523 0.0667585 0.0517261 ] [ 0.0109578 -0.0651624 0.0661774 ] [ -0.0498378 0.014653 -0.0537406 ] [ -0.046153 0.0439725 0.0606447 ] [ 0.0048133 -0.0067288 -0.0245605 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.148216337378072e-18 "source-value" -19.649621 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.400923226041526e-08 1.698356709283817e-08 8.652109451551584e-08 ] [ -4.656097461988003e-08 3.510745407569857e-08 1.124968181314061e-07 ] [ -1.128624007099106e-07 -8.166507646143491e-09 -1.69326081190411e-07 ] [ 5.786489288340027e-08 -4.201047562561946e-08 1.157030095502431e-08 ] [ 5.30155613532286e-09 -1.71893431277836e-08 -4.851257346469887e-09 ] [ 1.774230506862056e-07 1.111090869232466e-08 -5.734595092005873e-08 ] [ -9.517535663555336e-08 4.16439669890281e-09 2.093507601521113e-08 ] ] "source-value" [ [ 8.7438751 10.6003089 54.0022201 ] [ -29.0610748 21.9123495 70.2149917 ] [ -70.4431704 -5.0971332 -105.6850281 ] [ 36.1164257 -26.2208767 7.2216139 ] [ 3.3089711 -10.7287442 -3.0279167 ] [ 110.738759 6.9348838 -35.7925276 ] [ -59.4037857 2.599212 13.0666468 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 5.013174757726894e-18 "source-value" 31.289776 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] } "instance-id" 1 }