{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3207947 -21.2781755 4.4012105 ] [ -22.2401905 12.3213117 -2.8258712 ] [ 0.2636905 9.3594686 -4.5617383 ] [ 16.9965524 -6.8973331 -16.4490566 ] [ 10.3007423 6.4947282 19.4354555 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.52485287241655e-09 -3.409139531937935e-08 7.051516566319478e-09 ] [ -3.563271326123826e-08 1.97409175433295e-08 -4.527544770032041e-09 ] [ 4.224787542270624e-10 1.499552177403171e-08 -7.308710454467936e-09 ] [ 2.723147888948213e-08 -1.105074583868999e-08 -2.635429391873594e-08 ] [ 1.650360848994562e-08 1.040570168049047e-08 3.113903241669877e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.0777999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.454423876808058e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5751178 0.3280943 2.6577908 ] [ 1.768784 3.6763913 2.7545321 ] [ 2.733761 3.4324373 0.6234686 ] [ 3.850136 1.3630757 0.5636793 ] [ 2.2887602 1.7577962 4.0118083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5751178e-10 3.280943e-11 2.6577908e-10 ] [ 1.768784e-10 3.6763913e-10 2.7545321e-10 ] [ 2.733761e-10 3.4324373e-10 6.234686e-11 ] [ 3.850136e-10 1.3630757e-10 5.636793e-11 ] [ 2.2887602e-10 1.7577962e-10 4.0118083e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 -2.7e-06 3.6e-06 ] [ -2.7e-06 2.4e-06 1.2e-06 ] [ -6e-07 3e-06 -1.6e-06 ] [ 3.4e-06 -1.7e-06 -5.2e-06 ] [ 1e-06 -1e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 -4.32587687616e-15 5.76783583488e-15 ] [ -4.32587687616e-15 3.84522388992e-15 1.92261194496e-15 ] [ -9.6130597248e-16 4.8065298624e-15 -2.56348259328e-15 ] [ 5.44740051072e-15 -2.72370025536e-15 -8.33131842816e-15 ] [ 1.6021766208e-15 -1.6021766208e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }