{ "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" [ [ 2.272226 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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3324907 -6.1257766 -2.103297 ] [ -7.5349143 5.0092064 6.5980251 ] [ -4.7532836 1.5956735 -0.5339954 ] [ 5.3038529 -1.6905311 -3.1701309 ] [ 7.4964765 -6.1520001 4.426927 ] [ 1.8783385 -1.1499192 -9.9266794 ] [ 2.9420208 8.5133471 4.7091507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.543592000562303e-09 -9.814576133623963e-09 -3.369853307762297e-09 ] [ -1.207226363065246e-08 8.025633448963256e-09 1.057120164576551e-08 ] [ -7.6155999186954e-09 2.556550797192999e-09 -8.555549525434835e-10 ] [ 8.497709186553138e-09 -2.708529427470318e-09 -5.079109654701391e-09 ] [ 1.20106794856301e-08 -9.856590812585663e-09 7.092718999823718e-09 ] [ 3.009430055442609e-09 -1.842373673227973e-09 -1.590429378788914e-08 ] [ 4.713636982501987e-09 1.363988580075166e-08 7.544891217524744e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7267277 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.558393584622056e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2185072 1.4561148 2.8018947 ] [ 2.0034083 3.0756941 4.3759546 ] [ 1.5768471 3.9125146 2.1619676 ] [ 4.2577963 1.5635328 1.9067895 ] [ 4.2064225 2.2763696 4.3010233 ] [ 3.6074501 3.6169049 1.049971 ] [ 3.9107735 4.2205743 3.1619143 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2185072e-10 1.4561148e-10 2.8018947e-10 ] [ 2.0034083e-10 3.0756941e-10 4.3759546e-10 ] [ 1.5768471e-10 3.9125146e-10 2.1619676e-10 ] [ 4.2577963e-10 1.5635328e-10 1.9067895e-10 ] [ 4.206422500000001e-10 2.2763696e-10 4.3010233e-10 ] [ 3.6074501e-10 3.6169049e-10 1.049971e-10 ] [ 3.9107735e-10 4.2205743e-10 3.1619143e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9305413 -1.8749841 -0.2472946 ] [ -1.843397 1.0782829 1.1318921 ] [ -0.6736628 0.4047659 0.2366135 ] [ 2.0136065 -1.0844023 -0.4755331 ] [ 1.596641 -1.2524702 0.939342 ] [ -0.142784 0.4560597 -2.9791999 ] [ 0.9801376 2.2727481 1.3941798 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.093068161831984e-09 -3.004055714141519e-09 -3.962096298343763e-10 ] [ -2.953447600585698e-09 1.727599667221758e-09 1.813491074829191e-09 ] [ -1.079326797355015e-09 6.485064672199805e-10 3.79096620988959e-10 ] [ 3.22615328437052e-09 -1.737404026915858e-09 -7.618880215135853e-10 ] [ 2.558100903086394e-09 -2.006678489221307e-09 1.504991803734828e-09 ] [ -2.28765188509056e-10 7.306881950490498e-10 -4.773204467795136e-09 ] [ 1.570353560824838e-09 3.641343900787895e-09 2.233722299154793e-09 ] ] } "relaxed-potential-energy" { "source-value" -15.936851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.553365029173953e-18 } }