{
    "contributor-id" "4d62befd-21c4-42b8-a472-86132e6591f3" 
    "description" "This test computes the potential energy and forces of a periodic triclinic box of silicon atoms.  The box dimensions and atomic positions were obtained by perturbing a 64-atom simple hexagonal supercell (4x4x4 1-atom unit cells) constructed using a lattice constant of a=2.639 Angstroms with c/a=0.94 (equilibrium LDA-DFT values quoted in H. Balamane, T. Halicioglu, and W. Tiller, Phys. Rev. B 46, 2250 (1992).).  Each atomic position was perturbed in a random direction with a magnitude of displacement no greater than 0.5 Angstroms.  Each of the three supercell vectors was also perturbed randomly with a magnitude of displacement no greater than 0.5 Angstroms." 
    "disclaimer" "See the test driver source (TriclinicPBCEnergyAndForces__TD_892847239811_003) for required formatting of extended xyz file. This kimspec file was generated automatically using the openkim-pipeline `testgenie` utility along with the template files in the test driver directory." 
    "domain" "openkim.org" 
    "executables" [
        "runner"
    ] 
    "extended-id" "TriclinicPBCEnergyAndForces_sh64atom_Si__TE_462988072755_003" 
    "kim-api-version" "2.0" 
    "maintainer-id" "4d62befd-21c4-42b8-a472-86132e6591f3" 
    "matching-models" [
        "standard-models"
    ] 
    "publication-year" "2019" 
    "species" [
        "Si"
    ] 
    "test-driver" "TriclinicPBCEnergyAndForces__TD_892847239811_003" 
    "title" "Potential energy and atomic forces of periodic, non-orthogonal cell of Si atoms in a perturbed sh structure v003"
}