{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5098927 -2.5053802 0.7898848 ] [ -0.3996756 1.5219476 -1.1884068 ] [ -2.6920563 2.7028871 4.4832642 ] [ 7.4732873 -9.2705347 -19.2464237 ] [ 2.840437 -2.776816 27.4776054 ] [ -1.7120997 10.3278962 -12.3159238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.827821267056588e-09 -4.014061582655228e-09 1.265534959685284e-09 ] [ -6.403509022242125e-10 2.43842886280267e-09 -1.904037590959741e-09 ] [ -4.313149665737351e-09 4.330502520281911e-09 7.182981086109615e-09 ] [ 1.197352619258156e-08 -1.485303395865514e-08 -3.083617008615104e-08 ] [ 4.55088175425529e-09 -4.448949675463373e-09 4.402397696744784e-08 ] [ -2.743086111818694e-09 1.654711383368916e-08 -1.97322851759143e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7590354 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.420462013839576e-19 } "relaxed-configuration-positions" { "source-value" [ [ -1.1029577 0.965286 1.9957953 ] [ 0.3232864 2.5306852 0.6718161 ] [ 0.8344297 2.0801019 3.1099281 ] [ 3.9228437 1.2862074 1.0014501 ] [ 3.0380229 1.3380387 3.1390789 ] [ 2.2825203 2.0039986 -0.4645521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.1029577e-10 9.65286e-11 1.9957953e-10 ] [ 3.232864e-11 2.5306852e-10 6.718161e-11 ] [ 8.344297000000001e-11 2.0801019e-10 3.1099281e-10 ] [ 3.9228437e-10 1.2862074e-10 1.0014501e-10 ] [ 3.0380229e-10 1.3380387e-10 3.1390789e-10 ] [ 2.2825203e-10 2.0039986e-10 -4.645521e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.6e-06 -4.3e-06 5e-06 ] [ -4.9e-06 6e-07 -6.4e-06 ] [ 8e-07 7.2e-06 -2e-06 ] [ 1.1e-06 6e-07 6.8e-06 ] [ 3.3e-06 -5.9e-06 -1.34e-05 ] [ 4.3e-06 1.8e-06 1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.370012455680001e-15 -6.889359469440001e-15 8.010883104e-15 ] [ -7.850665441919999e-15 9.6130597248e-16 -1.025393037312e-14 ] [ 1.28174129664e-15 1.153567166976e-14 -3.2043532416e-15 ] [ 1.76239428288e-15 9.6130597248e-16 1.089480102144e-14 ] [ 5.28718284864e-15 -9.45284206272e-15 -2.146916671872e-14 ] [ 6.889359469440001e-15 2.88391791744e-15 1.6021766208e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.74192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.361915956970394e-18 } }