# BSE Version v0.9
# Data downloaded on 2022-02-15T18:31
# aug-cc-pVDZ-OPTRI version number 0
# Description: aug-cc-pVDZ-OPTRI
# Role: optri
# 
#  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,He,B-Ne,Al-Ar
#      aug-cc-pVDZ-OPTRI
#          yousaf2009a
# 
# 
# 
# yousaf2009a
#     Yousaf, Kazim E., Peterson, Kirk A.
#     Optimized complementary auxiliary basis sets for explicitly correlated
#             methods: aug-cc-pVnZ orbital basis sets
#     Chem. Phys. Lett. 476, 303-307 (2009)
#     10.1016/j.cplett.2009.06.003
# 
# # 
basis "H_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (3s,3p,2d) -> [3s,3p,2d]
H    S
      1.3200360              1.0000000
H    S
      0.2865400              1.0000000
H    S
      0.0813940              1.0000000
H    P
      2.6671610              1.0000000
H    P
      1.2510750              1.0000000
H    P
      0.2732020              1.0000000
H    D
      2.6047300              1.0000000
H    D
      0.7576340              1.0000000
end
basis "He_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (3s,3p,2d) -> [3s,3p,2d]
He    S
      2.0903700              1.0000000
He    S
      1.3972820              1.0000000
He    S
      0.1987340              1.0000000
He    P
      9.3168610              1.0000000
He    P
      4.0686780              1.0000000
He    P
      0.3995190              1.0000000
He    D
      3.1497420              1.0000000
He    D
      0.8377990              1.0000000
end
basis "B_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
B    S
      4.1926190              1.0000000
B    S
      1.1382240              1.0000000
B    S
      0.3090080              1.0000000
B    S
      0.0565720              1.0000000
B    P
      1.3540440              1.0000000
B    P
      0.6503250              1.0000000
B    P
      0.3123400              1.0000000
B    P
      0.1500120              1.0000000
B    P
      0.0502960              1.0000000
B    D
      3.7786290              1.0000000
B    D
      1.4068910              1.0000000
B    D
      0.5238250              1.0000000
B    D
      0.2281040              1.0000000
B    F
      1.6799280              1.0000000
B    F
      0.5801500              1.0000000
B    F
      0.1991350              1.0000000
B    G
      0.6245050              1.0000000
end
basis "C_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
C    S
      6.5475630              1.0000000
C    S
      1.8077410              1.0000000
C    S
      0.4991060              1.0000000
C    S
      0.0736010              1.0000000
C    P
      2.1536590              1.0000000
C    P
      1.0186560              1.0000000
C    P
      0.4818130              1.0000000
C    P
      0.2278920              1.0000000
C    P
      0.0952950              1.0000000
C    D
      8.1076690              1.0000000
C    D
      3.3473200              1.0000000
C    D
      1.3819690              1.0000000
C    D
      0.3330560              1.0000000
C    F
      2.6527500              1.0000000
C    F
      0.8918210              1.0000000
C    F
      0.3018960              1.0000000
C    G
      0.9734890              1.0000000
end
basis "N_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
N    S
      9.6745220              1.0000000
N    S
      2.6513720              1.0000000
N    S
      0.7266280              1.0000000
N    S
      0.0914490              1.0000000
N    P
      3.0159420              1.0000000
N    P
      1.4315730              1.0000000
N    P
      0.6795230              1.0000000
N    P
      0.3225480              1.0000000
N    P
      0.1151830              1.0000000
N    D
      6.9732270              1.0000000
N    D
      3.5880660              1.0000000
N    D
      1.8462350              1.0000000
N    D
      0.4224640              1.0000000
N    F
      4.0928370              1.0000000
N    F
      1.3976810              1.0000000
N    F
      0.5109860              1.0000000
N    G
      1.4841770              1.0000000
end
basis "O_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
O    S
     10.4831820              1.0000000
O    S
      3.0892910              1.0000000
O    S
      0.9103840              1.0000000
O    S
      0.1177850              1.0000000
O    P
      4.1809710              1.0000000
O    P
      1.9317780              1.0000000
O    P
      0.8925590              1.0000000
O    P
      0.4123990              1.0000000
O    P
      0.1022820              1.0000000
O    D
     12.7421470              1.0000000
O    D
      6.7100630              1.0000000
O    D
      3.5335450              1.0000000
O    D
      0.5339370              1.0000000
O    F
      4.8027300              1.0000000
O    F
      1.5579220              1.0000000
O    F
      0.5075660              1.0000000
O    G
      1.7631420              1.0000000
end
basis "F_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
F    S
     14.4511130              1.0000000
F    S
      4.2268530              1.0000000
F    S
      1.2363260              1.0000000
F    S
      0.1465130              1.0000000
F    P
      4.8372210              1.0000000
F    P
      2.2912080              1.0000000
F    P
      1.0852580              1.0000000
F    P
      0.5140460              1.0000000
F    P
      0.1269280              1.0000000
F    D
     15.8745470              1.0000000
F    D
      7.2781880              1.0000000
F    D
      3.3369150              1.0000000
F    D
      1.0954380              1.0000000
F    F
      6.1628770              1.0000000
F    F
      1.9800570              1.0000000
F    F
      0.6390790              1.0000000
F    G
      2.2741130              1.0000000
end
basis "Ne_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (4s,5p,4d,3f,1g) -> [4s,5p,4d,3f,1g]
Ne    S
     21.9574570              1.0000000
Ne    S
      6.0461550              1.0000000
Ne    S
      1.6648550              1.0000000
Ne    S
      0.1819800              1.0000000
Ne    P
      5.7247220              1.0000000
Ne    P
      2.7487190              1.0000000
Ne    P
      1.3197940              1.0000000
Ne    P
      0.6336980              1.0000000
Ne    P
      0.1858160              1.0000000
Ne    D
     20.9638000              1.0000000
Ne    D
     10.5525080              1.0000000
Ne    D
      5.3117950              1.0000000
Ne    D
      1.4772600              1.0000000
Ne    F
      8.2035020              1.0000000
Ne    F
      2.7058960              1.0000000
Ne    F
      0.9131770              1.0000000
Ne    G
      3.0002260              1.0000000
end
basis "Al_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
Al    S
      3.9673650              1.0000000
Al    S
      1.2994240              1.0000000
Al    S
      0.4255980              1.0000000
Al    S
      0.1393950              1.0000000
Al    S
      0.0402980              1.0000000
Al    P
      5.9229000              1.0000000
Al    P
      1.4784180              1.0000000
Al    P
      0.3690290              1.0000000
Al    P
      0.0921130              1.0000000
Al    P
      0.0276340              1.0000000
Al    D
      5.9949350              1.0000000
Al    D
      3.0500690              1.0000000
Al    D
      0.4256450              1.0000000
Al    D
      0.0826170              1.0000000
Al    F
      0.8542500              1.0000000
Al    F
      0.3447660              1.0000000
Al    F
      0.1161210              1.0000000
Al    G
      0.3282010              1.0000000
end
basis "Si_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
Si    S
      6.2072530              1.0000000
Si    S
      1.8198180              1.0000000
Si    S
      0.5335270              1.0000000
Si    S
      0.1564170              1.0000000
Si    S
      0.0562170              1.0000000
Si    P
      6.8941680              1.0000000
Si    P
      1.8814170              1.0000000
Si    P
      0.5134380              1.0000000
Si    P
      0.1401170              1.0000000
Si    P
      0.0500890              1.0000000
Si    D
     10.1970390              1.0000000
Si    D
      5.5203810              1.0000000
Si    D
      0.6207540              1.0000000
Si    D
      0.1343330              1.0000000
Si    F
      1.6385930              1.0000000
Si    F
      0.5116880              1.0000000
Si    F
      0.1826690              1.0000000
Si    G
      0.4501800              1.0000000
end
basis "P_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
P    S
      7.1364740              1.0000000
P    S
      2.2234140              1.0000000
P    S
      0.6927190              1.0000000
P    S
      0.2158210              1.0000000
P    S
      0.0740620              1.0000000
P    P
      8.0477160              1.0000000
P    P
      2.3068730              1.0000000
P    P
      0.6612640              1.0000000
P    P
      0.1895510              1.0000000
P    P
      0.0557330              1.0000000
P    D
     12.3056350              1.0000000
P    D
      6.3845350              1.0000000
P    D
      0.7746060              1.0000000
P    D
      0.1854590              1.0000000
P    F
      3.6145670              1.0000000
P    F
      0.6779060              1.0000000
P    F
      0.2635090              1.0000000
P    G
      0.5961990              1.0000000
end
basis "S_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
S    S
      8.4828690              1.0000000
S    S
      2.6380230              1.0000000
S    S
      0.8203790              1.0000000
S    S
      0.2551230              1.0000000
S    S
      0.0872200              1.0000000
S    P
      9.1016040              1.0000000
S    P
      2.6823510              1.0000000
S    P
      0.7905210              1.0000000
S    P
      0.2329760              1.0000000
S    P
      0.0738150              1.0000000
S    D
     17.4029820              1.0000000
S    D
      7.1745500              1.0000000
S    D
      0.9285230              1.0000000
S    D
      0.3008210              1.0000000
S    F
      5.0466780              1.0000000
S    F
      0.8342980              1.0000000
S    F
      0.3182260              1.0000000
S    G
      0.7469600              1.0000000
end
basis "Cl_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
Cl    S
     10.3367590              1.0000000
Cl    S
      3.2068640              1.0000000
Cl    S
      0.9948940              1.0000000
Cl    S
      0.3086550              1.0000000
Cl    S
      0.1107190              1.0000000
Cl    P
     10.1006700              1.0000000
Cl    P
      3.0713090              1.0000000
Cl    P
      0.9338930              1.0000000
Cl    P
      0.2839690              1.0000000
Cl    P
      0.0810640              1.0000000
Cl    D
     18.7088300              1.0000000
Cl    D
     11.6169920              1.0000000
Cl    D
      1.1387370              1.0000000
Cl    D
      0.3397210              1.0000000
Cl    F
      6.5104370              1.0000000
Cl    F
      1.0193730              1.0000000
Cl    F
      0.3884980              1.0000000
Cl    G
      0.9126230              1.0000000
end
basis "Ar_aug-cc-pVDZ-OPTRI" SPHERICAL 
#basis SET: (5s,5p,4d,3f,1g) -> [5s,5p,4d,3f,1g]
Ar    S
     10.6602660              1.0000000
Ar    S
      3.4076430              1.0000000
Ar    S
      1.0892820              1.0000000
Ar    S
      0.3481980              1.0000000
Ar    S
      0.1063090              1.0000000
Ar    P
     11.6954750              1.0000000
Ar    P
      3.6164960              1.0000000
Ar    P
      1.1182990              1.0000000
Ar    P
      0.3458030              1.0000000
Ar    P
      0.1154120              1.0000000
Ar    D
     24.2974700              1.0000000
Ar    D
     11.3177750              1.0000000
Ar    D
      1.4999190              1.0000000
Ar    D
      0.3918570              1.0000000
Ar    F
      7.5698470              1.0000000
Ar    F
      1.2793910              1.0000000
Ar    F
      0.5068880              1.0000000
Ar    G
      1.1295440              1.0000000
end
