This is an initial library of BibTex references for the lammps_step plug-in for SEAMM,
generated automatically by the cookiecutter. You may wish to edit the first entry to correct some
of the information.

Add other references to the end of the file and add code in the plug-in to cite the references as
appropriate. This is done with code like this:

        self.references.cite(
            raw=self._bibliography['doi:10.1002/jcc.21224'],
            alias='packmol',
            module='packmol_step',
            level=1,
            note='The principle PACKMOL citation.'
        )

which is typically in the run() method of the plug-in.

The base node class in SEAMM automatically reads this list of references into a dictionary in
self._bibliography with the key being the key of the BibTex entry -- usually the name on the
first line of the entry after the 'article' or 'misc' (for software) keyword.

See the documentation for the Reference Handler for the other arguments to cite().

# End of initial comments #

@Misc{ crystal_builder_step,
	author = {Paul Saxe},
	title = {Crystal Builder plug-in for SEAMM},
	month = {$month},
	year = {$year},
	organization = {The Molecular Sciences Software Institute (MolSSI)},
	url = {https://github.com/molssi-seamm/crystal_builder_step},
	address = {Virginia Tech, Blacksburg, VA, USA},
	version = {$version}
}

@article{MEHL2017S1,
    title = "The AFLOW Library of Crystallographic Prototypes: Part 1",
    journal = "Computational Materials Science",
    volume = "136",
    pages = "S1 - S828",
    year = "2017",
    issn = "0927-0256",
    doi = "https://doi.org/10.1016/j.commatsci.2017.01.017",
    url = "http://www.sciencedirect.com/science/article/pii/S0927025617300241",
    author = "Michael J. Mehl and David Hicks and Cormac Toher and Ohad Levy and Robert M. Hanson and Gus Hart and Stefano Curtarolo",
    keywords = "Crystal Structure, Space Groups, Wyckoff Positions, Lattice Vectors, Basis Vectors, Database",
}
@article{HICKS2019S1,
    title = "The AFLOW Library of Crystallographic Prototypes: Part 2",
    journal = "Computational Materials Science",
    volume = "161",
    pages = "S1 - S1011",
    year = "2019",
    issn = "0927-0256",
    doi = "https://doi.org/10.1016/j.commatsci.2018.10.043",
    url = "http://www.sciencedirect.com/science/article/pii/S0927025618307146",
    author = "David Hicks and Michael J. Mehl and Eric Gossett and Cormac Toher and Ohad Levy and Robert M. Hanson and Gus Hart and Stefano Curtarolo",
    keywords = "Crystal Structure, Space Groups, Wyckoff Positions, Lattice Vectors, Basis Vectors, Database",
}
@article{A_hP4_194_f,
    author = {Akira Yoshiasa and Yu Murai and Osamu Ohtaka and Tomoo Katsura},
    title = {Detailed Structures of Hexagonal Diamond (lonsdaleite) and Wurtzite-type BN},
    journal = {Japanese Journal of Applied Physics},
    volume = {42},
    pages = {1694-1704},
    year = 2003,
}
@article{A3B_cP8_223_c_a,
    author = "Jauch, W. and Schultz, A. J. and Heger, G.",
    title = "{Single-crystal time-of-flight neutron diffraction of Cr${\sb 3}$Si and MnF${\sb 2}$ comparison with monochromatic-beam techniques}",
    journal = "Journal of Applied Crystallography",
    year = "1987",
    volume = "20",
    number = "2",
    pages = "117--119",
    month = "Apr",
    doi = {10.1107/S002188988708703X},
    url = {https://doi.org/10.1107/S002188988708703X},
}
@article{A4B5_tI18_139_i_ah,
    author = {K. Schubert and H. G. Meissner and A. Raman and W. Rossteutscher},
    title = {Einige Strukturdaten metallischer Phasen (9)},
    journal = {Naturwissenschaften},
    volume = {51},
    pages = {287-287},
    year = 1964,
    doi = {10.1007/BF00625465},
    url = {https://doi.org/10.1007/BF00625465}
}
@article{A3B4_tI28_141_ad_h,
    author = {D. Jarosch},
    title = {Crystal structure refinement and reflectance measurements of hausmannite, Mn3O4},
    journal = {Mineralogy and Petrology},
    volume = {37},
    pages = {15-23},
    year = 1987,
    doi = {https://doi.org/10.1007/BF01163155}
}
@article{A5B2_hP14_194_abdf_f,
    author = {Roland Kiessling},
    title = {The Crystal Structures of Molybdenum and Tungsten Borides},
    journal = {Acta Chemica Scandinavica},
    volume = {1},
    pages = {893-916},
    year = 1947,
}
@article{A3BC_tP5_99_bc_a_b,
    title = {Tetragonal-to-monoclinic phase transition in a ferroelectric perovskite: The structure of PbZr0.52Ti0.48O3},
    author = {Noheda, B. and Gonzalo, J. A. and Cross, L. E. and Guo, R. and Park, S.-E. and Cox, D. E. and Shirane, G.},
    journal = {Phys. Rev. B},
    volume = {61},
    issue = {13},
    pages = {8687--8695},
    numpages = {0},
    year = {2000},
    month = {Apr},
    publisher = {American Physical Society},
    doi = {10.1103/PhysRevB.61.8687},
    url = {https://link.aps.org/doi/10.1103/PhysRevB.61.8687}
}
@article{A2B_tI24_141_2e_e,
    author = {K. Schubert and H. G. Meissner and M. P{\"{o}}tzschke and W. Rossteutscher and E. Stolz},
    title = {Einige Strukturdaten metallischer Phasen (7)},
    journal = {Naturwissenschaften},
    volume = {49},
    pages = {57-57},
    year = 1962,
    doi = {10.1007/BF00595382}
}
@article{A2B_tP12_92_b_a,
    author = {J. J. Pluth and J. V. Smith and J. Faber, Jr.},
    title = {Crystal structure of low cristobalite at 10, 293, and 473 K: Variation of framework geometry with temperature},
    journal = {Journal of Applied Physics},
    volume = {57},
    pages = {1045-1049},
    year = 1985,
    doi = {10.1063/1.334545},
    url = {https://doi.org/10.1063/1.334545},
    eprint = {https://doi.org/10.1063/1.334545}
}
@article{AB3_cP4_221_a_c,
    author = {E. A. Owen and Y. H. Liu},
    title = {XL. The thermal expansion of the gold-copper alloy AuCu3.},
    journal = {The London, Edinburgh, and Dublin Philosophical Magazine and Journal of Science},
    volume = {38},
    number = {280},
    pages = {354-360},
    year  = {1947},
    publisher = {Taylor & Francis},
    doi = {10.1080/14786444708521607},
    URL = {https://doi.org/10.1080/14786444708521607},
    eprint = {https://doi.org/10.1080/14786444708521607}
}
@article{AB3_oP16_18_ab_3c,
    author = {W. S. Miller and A. J. King},
    title = {The Structure of Polysuflides: 1 Barium Trisulfide},
    journal = {Zeitschrift f\"{u}r Kristallographie - Crystalline Materials},
    volume = {94},
    pages = {439-446},
    year = 1936,
    doi = "https://doi.org/10.1524/zkri.1936.94.1.439",
    url = "https://www.degruyter.com/view/journals/zkri/94/1/article-p439.xml"
}
@article{ABC2_hR4_166_a_b_c,
    author = {F. M. R. Engelsman and G. A. Wiegers and F. Jellinek and B. {Van Laar}},
    title = {Crystal structures and magnetic structures of some metal(I) chromium(III) sulfides and selenides},
    journal = {Journal of Solid State Chemistry},
    volume = {6},
    pages = {574-582},
    year = 1973,
    doi = "https://doi.org/10.1016/S0022-4596(73)80018-0",
    url = "http://www.sciencedirect.com/science/article/pii/S0022459673800180",
}
@article{AB11_cP36_221_c_agij,
    author = {G. Peyronel},
    title = {Struttura della fase BaHg11},
    journal = {Gazzetta Chimica Italiana},
    volume = {82},
    pages = {679-690},
    year = 1952,
}
@article{A2B_mC144_9_24a_12a,
    author = {Wayne A. Dollase and Werner H. Baur},
    title = {The superstructure of meteoritic low tridymite solved by computer simulation},
    journal = {American Mineralogist},
    volume = {61},
    pages = {971-978},
    year = 1976,
}
@article{AB_hP8_194_ad_f,
    author = {K. Bachmayer and H. Nowotny and A. Kohl},
    title = {Die Struktur von TiAs},
    journal = {Monatshefte f\"{u}r Chemie und verwandte Teile anderer Wissenschaften},
    volume = {86},
    pages = {39-43},
    year = 1955,
    doi = {10.1007/BF00899271},
    url = {https://doi.org/10.1007/BF00899271}
}
@article{A7B_cF32_225_bd_a,
    author = {O. Helleis and H. Kandler and E. Leicht and W. Quiring and E. W\"{o}lfel},
    title = {Die Kristallstrukturen der intermetallischen Phasen Ca33Ge, Ca7Ge, Ca3Pb und Ca5Pb3},
    journal = {Zeitschrift f\"{u}r anorganische und allgemeine Chemie},
    volume = {320},
    pages = {86-100},
    year = 1963,
    doi = {https://doi.org/10.1002/zaac.19633200113},
    url = {https://onlinelibrary.wiley.com/doi/abs/10.1002/zaac.19633200113},
}
@article{A_mP64_14_16e,
    author = {Olav Foss and Vitalijus Janickis},
    title = {X-Ray crystal structure of a new red, monoclinic form of cyclo-octaselenium, Se8},
    journal = {Journal of the Chemical Society, Chemical Communications},
    volume = {n/a},
    pages = {834-835},
    publisher = {The Royal Society of Chemistry},
    year = 1977,
    doi = {10.1039/C39770000834},
    url = {http://dx.doi.org/10.1039/C39770000834}
}
@article{A3B_hP4_191_bc_a,
    author = {Duncan H. Gregory and Paul M. O'Meara and Alexandra G. Gordon and Jason P. Hodges and Simine Short and James D. Jorgensen},
    title = {Structure of Lithium Nitride and Transition-Metal-Doped Derivatives, Li3-x-yMxN (M = Ni, Cu):  A Powder Neutron Diffraction Study},
    journal = {Chemistry of Materials},
    volume = {14},
    number = {5},
    pages = {2063-2070},
    year = {2002},
    doi = {10.1021/cm010718t},
    URL = {https://doi.org/10.1021/cm010718t},
    eprint = {https://doi.org/10.1021/cm010718t}
}
@article{ABC_oP6_59_a_a_a,
    author = {R. B. Heiart and G. B. Carpenter},
    title = {The crystal structure of cyanogen chloride},
    journal = {Acta Crystallographica},
    volume = {9},
    pages = {889-895},
    year = 1956,
}
@article{AB_oP8_62_c_c.GeS,
    author = {W. H. Zachariasen},
    title = {The Crystal Lattice of Germano Sulphide, GeS},
    journal = {Physical Review},
    volume = {40},
    pages = {917-922},
    year = 1932,
}
@article{A_mC4_12_i,
    author = {R. J. Meier and R. B. Helmholdt},
    title = {Neutron-diffraction study of $\alpha$- and $\beta$-oxygen},
    journal = {Physical Review B},
    volume = {29},
    pages = {1387-1393},
    year = 1984,
}
@article{AB_cP8_198_a_a.FeSi,
    author = {L. Vo\v{c}adlo and K. S. Knight and G. D. Price and I. G. Wood},
    title = {Thermal expansion and crystal structure of FeSi between 4 and 1173 K determined by time-of-flight neutron powder diffraction},
    journal = {Physics and Chemistry of Minerals},
    volume = {29},
    pages = {132-139},
    year = 2002,
}
@article{ABC3_hR10_161_a_a_b,
    author = {H. Boysen and F. Altorfer},
    title = {A neutron powder investigation of the high-temperature structure and phase transition in LiNbO$_3$},
    journal = {Acta Crystallographica B},
    volume = {50},
    pages = {405-414},
    year = 1994,
}
@article{A2BC4_cF56_227_d_a_e,
    author = {Roderick J. Hill and James R. Craig and G. V. Gibbs},
    title = {Systematics of the Spinel Structure Type},
    journal = {Physics and Chemistry of Minerals},
    volume = {4},
    pages = {317-339},
    year = 1979,
}
@article{AB_tP4_129_a_c,
    author = {P. Boher and P. Garnier and J. R. Gavarri and A. W. Hewat},
    title = {Monoxyde quadratique PbO$\alpha$(I): Description de la transition structurale ferroe'lastique},
    journal = {Journal of Solid State Chemistry},
    volume = {57},
    pages = {343-350},
    year = 1985,
}
@article{ABC3_hR10_167_a_b_e.CaCO3,
    author = {S. A. Markgraf and R. J. Reeder},
    title = {High-temperature structure refinements of calcite and magnesite},
    journal = {American Mineralogist},
    volume = {70},
    pages = {590-600},
    year = 1985,
}
@article{AB_oP8_62_c_c.FeB,
    author = {Sterling B. Hendricks and Peter R. Kosting},
    title = {The Crystal Structure of Fe$_2$P, Fe$_2$N, Fe$_3$N and FeB},
    journal = {Zeitschrift f\"{u}r Kristallographie - Crystalline Materials},
    volume = {74},
    pages = {511-533},
    year = 1930,
}
@article{A3B_tI16_139_cde_e,
    author = {Y. Ma and C. R{\o}mming and B. Lebech and J. Gj{\o}nnes and J. Taft{\o}},
    title = {Structure Refinement of AI3Zr using Single-Crystal X-ray Diffraction, Powder Neutron Diffraction and CBED},
    journal = {Acta Crystallographica B},
    volume = {48},
    pages = {11-16},
    year = 1992,
}
@article{AB2_mC6_12_a_i,
    author = {K. Reithmayer and W. Steurer and H. Schulz and J. L. de Boer},
    title = {High-pressure single-crystal structure study on calaverite, AuTe$_2$},
    journal = {Acta Crystallographica B},
    volume = {49},
    pages = {6-11},
    year = 1993,
}
@article{ABCD_tP8_129_c_b_a_c,
    author = {V. Johnson and W. Jeitschko},
    title = {ZrCuSiAs: A ``filled'' PbFCl type},
    journal = {Journal of Solid State Chemistry},
    volume = {11},
    pages = {161-166},
    year = 1974,
}
@article{A2B_mP12_3_bc3e_2e,
    author = {M. B. Boisen, Jr. and G. V. Gibbs and M. S. T. Bukowinski},
    title = {Framework silica structures generated using simulated annealing with a potential energy function based on an H$_6$Si$_2$O$_7$ molecule},
    journal = {Physics and Chemistry of Minerals},
    volume = {21},
    pages = {269-284},
    year = 1994,
}
@article{A2B_oP24_61_2c_c,
    author = {E. P. Meagher and G. A. Lager},
    title = {Polyhedral thermal expansion in the TiO$_2$ polymorphs; refinement of the crystal structures of rutile and brookite at high temperature},
    journal = {Canadian Mineralogist},
    volume = {17},
    pages = {77-85},
    year = 1979,
}
@article{AB_tP4_129_c_c,
    author = {V. N. Eremenko and Yu. I. Buyanov and S. B. Prima},
    title = {Phase diagram of the system titanium-copper},
    journal = {Soviet Powder Metallurgy and Metal Ceramics},
    volume = {5},
    pages = {494-502},
    year = 1966,
}
@article{A3B_cP4_221_d_a,
    author = {Karl Meisel},
    title = {Rheniumtrioxyd. III. Mitteilung. \"{U}ber die Kristallstruktur des Rheniumtrioxyds},
    journal = {Zeitschrift f\"{u}r anorganische und allgemeine Chemie},
    volume = {207},
    pages = {121-128},
    year = 1932,
}
@article{A_cF136_227_aeg,
    author = {Gary B. Adams and Michael O'Keeffe and Alexander A. Demkov and Otto F. Sankey and Yin-Min Huang},
    title = {Wide-band-gap Si in open fourfold-coordinated clathrate structures},
    journal = {Physical Review B},
    volume = {49},
    pages = {8048-8053},
    year = 1994,
}
@article{AB3C4_oP16_31_a_ab_2ab,
    author = {G. Adiwidjaja and J. L{\"{o}}hn},
    title = {Strukturverfeinerung von Enargit, Cu$_3$AsS$_4$},
    journal = {Acta Crystallographica B},
    volume = {26},
    pages = {1878-1879},
    year = 1970,
}
@article{A3B4C_cP8_215_d_e_a,
    author = {Felix J. Trojer},
    title = {Refinement of the Structure of Sulvanite},
    journal = {American Mineralogist},
    volume = {51},
    pages = {890-894},
    year = 1966,
}
@article{A3B_oP8_59_bf_a,
    author = {N. Karlsson},
    title = {~},
    journal = {Journal of the Institute of Metals},
    volume = {79},
    pages = {391-391},
    year = 1951,
}
@article{AB3C4_oP32_33_a_3a_4a,
    author = {M. Palazzi and S. Jaulmes and P. Laruelle},
    title = {Structure cristalline de K$_3$AsS$_4$},
    journal = {Acta Crystallographica B},
    volume = {30},
    pages = {2378-2381},
    year = 1974,
}
@article{A6B23_cF116_225_e_acfh,
    author = {A. L. Bowman and G. P. Arnold and E. K. Storms and N. G. Nereson},
    title = {The crystal structure of Cr$_{23}$C$_6$},
    journal = {Acta Crystallographica B},
    volume = {28},
    pages = {3102-3103},
    year = 1972,
}
@article{A7B6_hR13_166_ah_3c,
    author = {H. Arnfelt},
    title = {Crystal Structure of Fe$_7$W$_6$},
    journal = {Jernkontorets Annaler},
    volume = {119},
    pages = {185-187},
    year = 1935,
}
@article{AB2_oI6_71_a_i,
    author = {T. Siegrist and F. Hulliger and G. Travaglini},
    title = {The crystal structure and some properties of ReSi$_2$},
    journal = {Journal of the Less Common Metals},
    volume = {92},
    pages = {119-129},
    year = 1983,
}
@article{ABC_cF12_216_b_c_a,
    author = {H. Nowotny and W. Sibert},
    title = {Tern\"{a}re Valenzverbindungen in den Systemen Kupfer(Silber)-Arsen(Antimon,Wismut)-Magnesium},
    journal = {Zeitschrift f\"{u}r Metallkunde},
    volume = {33},
    pages = {391-394},
    year = 1941,
}
@article{A2B7_cI54_229_e_afh,
    author = {Rolf Stokhuyzen and Chung Chieh and William B. Pearson},
    title = {Crystal Structure of Sb$_2$Tl$_7$},
    journal = {Canadian Journal of Chemistry},
    volume = {55},
    pages = {1120-1122},
    year = 1977,
}
@article{A5B3C_hP18_186_2a3b_2ab_b,
    author = {G. A. Jeffrey and Victor Y. Wu},
    title = {The structure of the aluminum carbonitrides. II},
    journal = {Acta Crystallographica},
    volume = {20},
    pages = {538-547},
    year = 1966,
}
@article{AB_hP6_154_a_b,
    author = {P. Auvray and F. Genet},
    title = {Affinement de la structure cristalline du cinabre $\alpha$-HgS},
    journal = {Bulletin de la Societe Francaise de Mineralogie et de Cristallographie},
    volume = {96},
    pages = {218-219},
    year = 1973,
}
@article{A3B_tI8_139_bd_a,
    author = {P. Norby and A. N{\o}rlund Christensen},
    title = {Preparation and Structure of Al$_3$Ti},
    journal = {Acta Chemica Scandinavica},
    volume = {A40},
    pages = {157-159},
    year = 1986,
}
@article{A_tI8_139_h,
    author = {Peter A. Schultz and Kevin Leung and E. B. Stechel},
    title = {Small rings and amorphous tetrahedral carbon},
    journal = {Physical Review B},
    volume = {59},
    pages = {733-741},
    year = 1999,
}
@article{AB_oP4_51_e_f,
    author = {L.-C. Chang},
    title = {Atomic displacements and crystallographic mechanisms in diffusionless transformation of gold-cadium single crystals containing 47.5 atomic per cent cadmium},
    journal = {Acta Crystallographica},
    volume = {4},
    pages = {320-324},
    year = 1951,
}
@article{AB4_tI10_87_a_h,
    author = {David Harker},
    title = {The Crystal Structure of Ni$_4$Mo},
    journal = {Journal of Chemical Physics},
    volume = {12},
    pages = {315-315},
    year = 1944,
}
@article{AB32C48_cI162_204_a_2efg_2gh,
    author = {Gunnar Bergman and John L. T. Waugh and Linus Pauling},
    title = {The crystal structure of the metallic phase Mg$_{32}$(Al, Zn)$_{49}$},
    journal = {Acta Crystallographica},
    volume = {10},
    pages = {254-259},
    year = 1957,
}
@article{ABC_hP3_187_a_d_f,
    author = {G. Wenski and A. Mewis},
    title = {Trigonal-planar koordiniertes Platin: Darstellung und Struktur von SrPtAs (Sb), BaPtP (As, Sb), SrPt$_x$P$_{2-x}$, SrPt$_x$As$_{0.90}$ und BaPt$_x$As$_{0.90}$},
    journal = {Zeitschrift f\"{u}r anorganische und allgemeine Chemie},
    volume = {535},
    pages = {110-122},
    year = 1986,
}
@article{AB_cI16_199_a_a,
    author = {N. C. Baenziger and R. E. Rundle and A. I. Snow and A. S. Wilson},
    title = {Compounds of uranium with the transition metals of the first long period},
    journal = {Acta Crystallographica},
    volume = {3},
    pages = {34-40},
    year = 1950,
}
@article{A3B2_hP5_164_ad_d,
    author = {A. J. Bradley and A. Taylor},
    title = {The crystal structures of Ni$_2$Al$_3$ and NiAl$_3$},
    journal = {Philosophical Magazine},
    volume = {23},
    pages = {1049-1067},
    year = 1937,
}
@article{A2BC4D_tI16_121_d_a_i_b,
    author = {L. O. Brockway},
    title = {The Crystal Structure of Stannite, Cu$_2$FeSnS$_4$},
    journal = {Zeitschrift f\"{u}r Kristallographie - Crystalline Materials},
    volume = {89},
    pages = {434-441},
    year = 1934,
}
@article{A_tI2_139_a.alpha-Pa,
    author = {W. H. Zachariasen},
    title = {On the crystal structure of protactinium metal},
    journal = {Acta Crystallographica},
    volume = {12},
    pages = {698-700},
    year = 1959,
}
@article{AB_hP4_186_b_a,
    author = {A. Brager},
    title = {X-ray examination of the structure of boron nitride},
    journal = {Acta Physicochimica URSS},
    volume = {7},
    pages = {699-706},
    year = 1937,
}
@article{AB_oP8_62_c_c.MnP,
    author = {Helmer Fjellv\r{a}g and Arne Kjekshus},
    title = {Magnetic and Structural Properties of Transition Metal Substituted MnP. I. Mn$_{1-t}$Co$_t$P ($0.00<=t<=0.30$).},
    journal = {Acta Chemica Scandinvaca A},
    volume = {38},
    pages = {563-573},
    year = 1984,
}
@article{AB4C3_cI16_229_a_c_b,
    author = {Michael J. Mehl},
    title = {Hypothetical cI16 Austenite Structure},
    journal = {None},
    volume = {0},
    pages = {0-0},
    year = 2008,
}
@article{A3B_cI32_204_g_c,
    author = {Neil Mandel and Jerry Donohue},
    title = {The refinement of the crystal structure of skutterudite, CoAs$_3$},
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