{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.317425 2.441467 0.3846032 ] [ 3.811793 1.686821 2.499749 ] [ 3.76463 3.669357 1.636357 ] [ 5.464723 3.213327 3.188752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317425e-10 2.441467e-10 3.846032e-11 ] [ 3.811793000000001e-10 1.686821e-10 2.499749e-10 ] [ 3.76463e-10 3.669357000000001e-10 1.636357e-10 ] [ 5.464723000000001e-10 3.213327e-10 3.188752e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2269721 -0.6436463 -0.1390971 ] [ -0.474435 -2.529695 0.6422495 ] [ 0.0479307 3.1091705 -0.8898082 ] [ 0.6534764 0.0641708 0.3866558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.636493921938798e-10 -1.031235053924423e-09 -2.228581216410797e-10 ] [ -7.601286650892479e-10 -4.053018186754655e-09 1.02899713362049e-09 ] [ 7.679344695857855e-11 4.981440285181047e-09 -1.425629895036131e-09 ] [ 1.046984610324549e-09 1.028129554980326e-10 6.194908830567206e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.9764886203271192 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.768860479565358e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6129299 2.4120588 0.8551081 ] [ 3.7927246 1.1832167 2.479721 ] [ 3.8865611 4.3222689 1.3750094 ] [ 5.0663554 3.0934275 2.9996227 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6129299e-10 2.4120588e-10 8.551081000000001e-11 ] [ 3.7927246e-10 1.1832167e-10 2.479721e-10 ] [ 3.8865611e-10 4.3222689e-10 1.3750094e-10 ] [ 5.0663554e-10 3.0934275e-10 2.9996227e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-05 -6.6e-06 -2.1e-05 ] [ 2.2e-06 1.37e-05 -3e-06 ] [ -1.9e-06 -9.5e-06 1.8e-06 ] [ 2.37e-05 2.3e-06 2.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.84522388992e-14 -1.057436569728e-14 -3.36457090368e-14 ] [ 3.52478856576e-15 2.194981970496e-14 -4.8065298624e-15 ] [ -3.04413557952e-15 -1.52206778976e-14 2.88391791744e-15 ] [ 3.797158591296e-14 3.68500622784e-15 3.572853864384e-14 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }