# BSE Version 0.11.dev17+g4fabcd53
# Data downloaded on 2024-11-21T16:45
# DFO-1-BHS version number 1
# Description: Optimized gaussian basis set for Density-functional calculations (requiring pseudopotential)
# Role: orbital
# 
#  If you downloaded data from the basis set
#  exchange or used the basis set exchange python library, please cite:
# 
# pritchard2019a
#     Pritchard, Benjamin P., Altarawy, Doaa, Didier, Brett, Gibsom, Tara
#             D., Windus, Theresa L.
#     A New Basis Set Exchange: An Open, Up-to-date Resource for the
#             Molecular Sciences Community
#     J. Chem. Inf. Model. 59, 4814-4820 (2019)
#     10.1021/acs.jcim.9b00725
# 
# feller1996a
#     Feller, David
#     The role of databases in support of computational chemistry
#             calculations
#     J. Comput. Chem. 17, 1571-1586 (1996)
#     10.1002/(SICI)1096-987X(199610)17:13<1571::AID-JCC9>3.0.CO;2-P
# 
# schuchardt2007a
#     Schuchardt, Karen L., Didier, Brett T., Elsethagen, Todd, Sun, Lisong,
#             Gurumoorthi, Vidhya, Chase, Jared, Li, Jun, Windus, Theresa L.
#     Basis Set Exchange: A Community Database for Computational Sciences
#     J. Chem. Inf. Model. 47, 1045-1052 (2007)
#     10.1021/ci600510j
# 
# 
#  References for the basis set
# 
#  Si
#      Optimized gaussian basis set for Density-functional calculations (requiring pseudopotential)
#          porezag1999a
# 
# 
# 
# porezag1999a
#     Porezag, Dirk, Pederson, Mark R.
#     Optimization of Gaussian basis sets for density-functional
#             calculations
#     Phys. Rev. A 60, 2840-2847 (1999)
#     10.1103/PhysRevA.60.2840
# 
# # 
basis "Si_DFO-1-BHS" SPHERICAL 
#basis SET: (7s,7p,2d) -> [2s,2p,1d]
Si    S
      2.23626e+00            1.23450e-01
      1.33476e+00           -4.06338e-01
      3.95680e-01            3.17372e-01
      1.52472e-01            7.43263e-01
      5.42228e-02            1.51311e-01
Si    S
      1.52472e-01            2.78989e-01
      5.42228e-02            7.57275e-01
Si    P
      2.23626e+00            6.57953e-04
      1.33476e+00           -1.93641e-02
      3.95680e-01            2.96728e-01
      1.52472e-01            5.20318e-01
      5.42228e-02            3.26872e-01
Si    P
      1.52472e-01            2.26183e-01
      5.42228e-02            8.23610e-01
Si    D
      3.95680e-01            6.81837e-01
      1.52472e-01            4.01981e-01
end
