{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2014716e-10 1.1351477e-10 4.332195300000001e-10 ] [ 1.9449463e-10 5.3083578e-10 2.0048539e-10 ] [ 3.2433978e-10 3.2380259e-10 9.101356e-11 ] [ 1.3284422e-10 3.3939641e-10 2.884969e-10 ] [ 3.2430073e-10 1.6732064e-10 2.4497672e-10 ] [ 4.0708164e-10 4.5022578e-10 3.3337673e-10 ] [ 3.0142454e-10 3.1622772e-10 4.7155065e-10 ] ] "source-value" [ [ 2.2014716 1.1351477 4.3321953 ] [ 1.9449463 5.3083578 2.0048539 ] [ 3.2433978 3.2380259 0.9101356 ] [ 1.3284422 3.3939641 2.884969 ] [ 3.2430073 1.6732064 2.4497672 ] [ 4.0708164 4.5022578 3.3337673 ] [ 3.0142454 3.1622772 4.7155065 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.005472693600499e-10 9.055133760138817e-10 -4.337418956536244e-10 ] [ 9.25192911447168e-12 2.875442403115968e-11 -1.322740996366272e-11 ] [ 1.817706226359878e-10 9.838902541267969e-11 -3.329371083321024e-10 ] [ -2.01385590351456e-11 -2.724677583098688e-11 1.40799281435904e-12 ] [ -8.047294169884301e-10 -7.885065776145196e-10 4.511396111435673e-10 ] [ 2.489066295773703e-10 5.810189373850849e-10 5.968284151908289e-11 ] [ -5.15608634881966e-10 -7.979225696149613e-10 2.676759684723802e-10 ] ] "source-value" [ [ 0.5620774 0.565177 -0.2707204 ] [ 0.0057746 0.0179471 -0.0082559 ] [ 0.1134523 0.0614096 -0.207803 ] [ -0.0125695 -0.0170061 0.0008788 ] [ -0.5022726 -0.4921471 0.2815792 ] [ 0.1553553 0.3626435 0.0372511 ] [ -0.3218176 -0.4980241 0.1670702 ] ] } "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" -2.024399988073707e-18 "source-value" -12.635311 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.812880181986237e-08 1.76874117738917e-08 -3.381939619773106e-09 ] [ -1.295817699995025e-09 -4.150595229055915e-09 1.94643583065831e-09 ] [ 6.444935221384855e-09 -1.431471302821438e-08 1.708274615154256e-08 ] [ 1.295817699995025e-09 4.150595229055915e-09 -1.94643583065831e-09 ] [ -1.603674752071045e-08 1.173334437601041e-08 -8.101693032907986e-09 ] [ 2.589907292286855e-10 4.528923923667226e-10 -1.620167462074963e-10 ] [ -8.795980249765457e-09 -1.555893551405446e-08 -5.437096912871635e-09 ] ] "source-value" [ [ 11.3151082 11.0396142 -2.1108407 ] [ -0.8087858 -2.5905978 1.2148697 ] [ 4.0226122 -8.9345412 10.6622116 ] [ 0.8087858 2.5905978 -1.2148697 ] [ -10.0093506 7.3233776 -5.0566791 ] [ 0.1616493 0.2826732 -0.1011229 ] [ -5.4900191 -9.7111238 -3.393569 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.38507995833085e-18 "source-value" -8.6449892 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] } "instance-id" 1 }