{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.7922333e-10 1.2359217e-10 2.5583647e-10 ] [ 2.1484457e-10 3.0567007e-10 4.270040500000001e-10 ] [ 1.4153768e-10 3.5319807e-10 1.9852151e-10 ] [ 4.0426416e-10 1.53461e-10 2.0954234e-10 ] [ 4.4350714e-10 2.435176e-10 4.2158227e-10 ] [ 3.619425e-10 3.7353014e-10 1.3066066e-10 ] [ 4.3280113e-10 4.5920145e-10 3.328042e-10 ] ] "source-value" [ [ 1.7922333 1.2359217 2.5583647 ] [ 2.1484457 3.0567007 4.2700405 ] [ 1.4153768 3.5319807 1.9852151 ] [ 4.0426416 1.53461 2.0954234 ] [ 4.4350714 2.435176 4.2158227 ] [ 3.619425 3.7353014 1.3066066 ] [ 4.3280113 4.5920145 3.328042 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.39140882420608e-12 -3.11767548641472e-12 2.70383326526208e-12 ] [ -5.90898759517248e-12 -7.5214181463456e-12 -1.79251520335104e-12 ] [ -3.46454672481792e-12 8.544087483402241e-12 -3.8588423911968e-12 ] [ 4.770000235445761e-12 1.313784829056e-13 4.81357943953152e-12 ] [ 4.710719700476161e-12 4.85763929660352e-12 -1.39773888398592e-12 ] [ -4.96370338890048e-12 -5.4009373887168e-13 -3.5223853008288e-12 ] [ 7.247766379512961e-12 -2.35407810894144e-12 3.05406907456896e-12 ] ] "source-value" [ [ -0.0014926 -0.0019459 0.0016876 ] [ -0.0036881 -0.0046945 -0.0011188 ] [ -0.0021624 0.0053328 -0.0024085 ] [ 0.0029772 8.2e-05 0.0030044 ] [ 0.0029402 0.0030319 -0.0008724 ] [ -0.0030981 -0.0003371 -0.0021985 ] [ 0.0045237 -0.0014693 0.0019062 ] ] } "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" -3.57338610745743e-18 "source-value" -22.303322 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.00329359334727e-09 -8.997937016082228e-09 -3.349151876316745e-09 ] [ -7.961581405677729e-09 5.064032650200949e-09 7.228117605870794e-09 ] [ -5.342646037592881e-09 8.386511810569939e-10 -8.950316161252838e-10 ] [ 5.133811767913665e-09 -2.129855573690087e-09 -3.274895476037203e-09 ] [ 8.50361698261382e-09 -5.34252266999308e-09 4.957933470235993e-09 ] [ 1.788255175933995e-09 -1.093256592656888e-09 -1.187815743031674e-08 ] [ 5.881837110156403e-09 1.166088802116434e-08 7.211185322689193e-09 ] ] "source-value" [ [ -4.995263 -5.6160706 -2.0903762 ] [ -4.9692283 3.1607206 4.5114362 ] [ -3.3346174 0.5234449 -0.5586348 ] [ 3.2042733 -1.3293513 -2.044029 ] [ 5.3075403 -3.3345404 3.0944987 ] [ 1.1161411 -0.6823571 -7.4137628 ] [ 3.671154 7.2781539 4.5008679 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.8460094572859e-18 "source-value" -17.763394 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] } "instance-id" 1 }