{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.903174e-11 1.511895e-11 6.773024e-11 ] [ 1.9753024e-10 2.0996859e-10 1.147479e-11 ] [ -3.6112e-13 2.163502e-10 1.9549445e-10 ] [ 2.4294701e-10 -2.610267e-11 -3.55002e-12 ] [ 2.0930567e-10 3.2700935e-10 2.2170038e-10 ] ] "source-value" [ [ 0.1903174 0.1511895 0.6773024 ] [ 1.9753024 2.0996859 0.1147479 ] [ -0.0036112 2.163502 1.9549445 ] [ 2.4294701 -0.2610267 -0.0355002 ] [ 2.0930567 3.2700935 2.2170038 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.16526305630784e-12 -3.49370633931648e-12 -2.06424435823872e-12 ] [ -1.96555027839744e-12 2.20331328892416e-12 2.61787648955616e-11 ] [ 1.441766697525504e-11 -3.528794007312e-12 -9.08338013396352e-12 ] [ -8.719846258704e-12 -8.4610947344448e-13 -5.02058065893888e-12 ] [ -4.89753349446144e-12 5.66545674881088e-12 -1.001055974442048e-11 ] ] "source-value" [ [ 0.0007273 -0.0021806 -0.0012884 ] [ -0.0012268 0.0013752 0.0163395 ] [ 0.0089988 -0.0022025 -0.0056694 ] [ -0.0054425 -0.0005281 -0.0031336 ] [ -0.0030568 0.0035361 -0.0062481 ] ] } "species" { "source-value" [ "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" -2.409007452644271e-18 "source-value" -15.035842 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.565915237417417e-09 -1.474779819167114e-08 -5.331867554594113e-10 ] [ 8.262572874585361e-09 1.022364971563987e-08 -5.51035916255797e-09 ] [ -2.994980800793855e-10 1.149088314276086e-08 1.160225540642019e-08 ] [ 5.618335933304841e-09 -3.90651018980118e-09 4.675390103810899e-10 ] [ -6.015495490393401e-09 -3.060224476928411e-09 -6.026248338566239e-09 ] ] "source-value" [ [ -4.7222729 -9.2048517 -0.332789 ] [ 5.1570924 6.3811003 -3.4392957 ] [ -0.186932 7.1720452 7.2415583 ] [ 3.5066895 -2.4382519 0.2918149 ] [ -3.754577 -1.9100419 -3.7612884 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.25539609763707e-18 "source-value" -7.8355662 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.476445e-12 1.43829e-11 6.473223999999999e-11 ] [ 1.313892e-10 1.683397e-10 7.692831e-12 ] [ 1.194939e-11 2.399252e-10 1.546304e-10 ] [ 2.728192e-10 2.406182e-11 1.106797e-11 ] [ 2.458193e-10 2.956348e-10 2.547264000000001e-10 ] ] "source-value" [ [ 0.06476445 0.143829 0.6473224 ] [ 1.313892 1.683397 0.07692831 ] [ 0.1194939 2.399252 1.546304 ] [ 2.728192 0.2406182 0.1106797 ] [ 2.458193 2.956348 2.547264 ] ] } "instance-id" 1 }