# BSE Version v0.9
# Data downloaded on 2022-02-15T18:31
# TZ (Dunning-Hay) version number 0
# Description: TZ (Dunning-Hay)
# 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
# 
#  H,Li-Ne
#      TZ (dunhay)
#          dunning1971a
# 
# 
# 
# dunning1971a
#     Dunning, Thom H.
#     Gaussian Basis Functions for Use in Molecular Calculations. III.
#             Contraction of (10s6p) Atomic Basis Sets for the First-Row
#             Atoms
#     J. Chem. Phys. 55, 716-723 (1971)
#     10.1063/1.1676139
# 
# # 
basis "H_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (5s) -> [3s]
H    S
     74.6900000              0.0253740
     11.2300000              0.1896840
      2.5460000              0.8529330
H    S
      0.7130000              1.0000000
H    S
      0.2249000              1.0000000
end
basis "Li_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (10s) -> [4s]
Li    S
   1783.0000000              0.0008240
    267.1000000              0.0064030
     60.0700000              0.0332390
     16.7800000              0.1266210
      5.4030000              0.3377490
      1.9060000              0.5756690
      0.2634000              0.0623110
Li    S
      0.7179000              1.0000000
Li    S
      0.0771600              1.0000000
Li    S
      0.0285400              1.0000000
end
basis "Be_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s) -> [5s]
Be    S
   3630.0000000              0.0008390
    532.3000000              0.0067350
    117.8000000              0.0357260
     32.6600000              0.1386350
     10.4800000              0.3853990
      3.6680000              0.5476880
Be    S
      3.6680000              0.2134060
      1.3540000              0.8146920
Be    S
      0.3890000              1.0000000
Be    S
      0.1502000              1.0000000
Be    S
      0.0524100              1.0000000
end
basis "B_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
B    S
   6250.0000000              0.0007980
    916.1000000              0.0064100
    202.2000000              0.0342990
     55.8300000              0.1354870
     17.8600000              0.3885320
      6.2530000              0.5477580
B    S
      6.2530000              0.2326430
      2.3120000              0.7972190
B    S
      0.6824000              1.0000000
B    S
      0.2604000              1.0000000
B    S
      0.0894000              1.0000000
B    P
     15.4600000              0.0168220
      3.4830000              0.1008780
      1.0660000              0.3368950
      0.3928000              0.6723170
B    P
      0.1503000              1.0000000
B    P
      0.0572200              1.0000000
end
basis "C_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
C    S
   9471.0000000              0.0007760
   1398.0000000              0.0062180
    307.5000000              0.0335750
     84.5400000              0.1342780
     26.9100000              0.3936680
      9.4090000              0.5441690
C    S
      9.4090000              0.2480750
      3.5000000              0.7828440
C    S
      1.0680000              1.0000000
C    S
      0.4002000              1.0000000
C    S
      0.1351000              1.0000000
C    P
     25.3700000              0.0162950
      5.7760000              0.1020980
      1.7870000              0.3402280
      0.6577000              0.6682690
C    P
      0.2480000              1.0000000
C    P
      0.0910600              1.0000000
end
basis "N_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
N    S
  13520.0000000              0.0007600
   1999.0000000              0.0060760
    440.0000000              0.0328470
    120.9000000              0.1323960
     38.4700000              0.3932610
     13.4600000              0.5463390
N    S
     13.4600000              0.2520360
      4.9930000              0.7793850
N    S
      1.5690000              1.0000000
N    S
      0.5800000              1.0000000
N    S
      0.1923000              1.0000000
N    P
     35.9100000              0.0169160
      8.4800000              0.1022000
      2.7060000              0.3381340
      0.9921000              0.6692810
N    P
      0.3727000              1.0000000
N    P
      0.1346000              1.0000000
end
basis "O_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
O    S
  18050.0000000              0.0007570
   2660.0000000              0.0060660
    585.7000000              0.0327820
    160.9000000              0.1326090
     51.1600000              0.3968390
     17.9000000              0.5425720
O    S
     17.9000000              0.2624900
      6.6390000              0.7698280
O    S
      2.0770000              1.0000000
O    S
      0.7736000              1.0000000
O    S
      0.2558000              1.0000000
O    P
     49.8300000              0.0163580
     11.4900000              0.1064530
      3.6090000              0.3493020
      1.3210000              0.6571830
O    P
      0.4821000              1.0000000
O    P
      0.1651000              1.0000000
end
basis "F_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
F    S
  23340.0000000              0.0007570
   3431.0000000              0.0060810
    757.7000000              0.0326360
    209.2000000              0.1317040
     66.7300000              0.3962400
     23.3700000              0.5436720
F    S
     23.3700000              0.2648930
      8.6240000              0.7679250
F    S
      2.6920000              1.0000000
F    S
      1.0090000              1.0000000
F    S
      0.3312000              1.0000000
F    P
     65.6600000              0.0160370
     15.2200000              0.1056970
      4.7880000              0.3502270
      1.7320000              0.6581950
F    P
      0.6206000              1.0000000
F    P
      0.2070000              1.0000000
end
basis "Ne_TZ (Dunning-Hay)" SPHERICAL 
#basis SET: (11s,6p) -> [5s,3p]
Ne    S
  28660.0000000              0.0007670
   4263.0000000              0.0060680
    946.8000000              0.0324740
    261.5000000              0.1314680
     83.3400000              0.3977230
     29.1700000              0.5424910
Ne    S
     29.1700000              0.2690650
     10.7600000              0.7641210
Ne    S
      3.3430000              1.0000000
Ne    S
      1.2410000              1.0000000
Ne    S
      0.4063000              1.0000000
Ne    P
     84.8400000              0.0155500
     19.7100000              0.1030110
      6.2190000              0.3492150
      2.2110000              0.6628390
Ne    P
      0.7853000              1.0000000
Ne    P
      0.2566000              1.0000000
end
