# BSE Version v0.9
# Data downloaded on 2022-02-15T18:31
# cc-pVTZ-F12-OPTRI version number 0
# Description: cc-pVTZ-F12-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,B-Ne,Al-Ar
#      cc-pVTZ-F12-OPTRI
#          yousaf2008a
# 
#  Li,Be,Na,Mg
#      cc-pVTZ-F12-OPTRI
#          hill2010b
# 
# 
# 
# hill2010b
#     Hill, J. Grant, Peterson, Kirk A.
#     Correlation consistent basis sets for explicitly correlated
#             wavefunctions: valence and core-valence basis sets for Li, Be,
#             Na, and Mg
#     Phys. Chem. Chem. Phys. 12, 10460 (2010)
#     10.1039/c0cp00020e
# 
# yousaf2008a
#     Yousaf, Kazim E., Peterson, Kirk A.
#     Optimized auxiliary basis sets for explicitly correlated methods
#     J. Chem. Phys. 129, 184108 (2008)
#     10.1063/1.3009271
# 
# # 
basis "H_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (3s,3p,3d,2f) -> [3s,3p,3d,2f]
H    S
      2.0176510              1.0000000
H    S
      0.4616170              1.0000000
H    S
      0.1346590              1.0000000
H    P
      9.4397130              1.0000000
H    P
      1.0331850              1.0000000
H    P
      0.3718720              1.0000000
H    D
      2.2303390              1.0000000
H    D
      0.7029740              1.0000000
H    D
      0.3089650              1.0000000
H    F
      1.8671080              1.0000000
H    F
      0.7387620              1.0000000
end
basis "Li_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Li    S
      0.2844895              1.0000000
Li    S
      0.0651901              1.0000000
Li    S
      0.0305793              1.0000000
Li    S
      0.0099609              1.0000000
Li    P
      0.7984189              1.0000000
Li    P
      0.2420359              1.0000000
Li    P
      0.0676842              1.0000000
Li    P
      0.0296357              1.0000000
Li    D
      0.7369421              1.0000000
Li    D
      0.1672918              1.0000000
Li    D
      0.0847281              1.0000000
Li    D
      0.0398337              1.0000000
Li    F
      0.7925600              1.0000000
Li    F
      0.2219588              1.0000000
Li    F
      0.1256544              1.0000000
Li    G
      0.6243343              1.0000000
Li    G
      0.2964878              1.0000000
end
basis "Be_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Be    S
      1.0389253              1.0000000
Be    S
      0.1931279              1.0000000
Be    S
      0.0721684              1.0000000
Be    S
      0.0554719              1.0000000
Be    P
      3.8458994              1.0000000
Be    P
      0.5398595              1.0000000
Be    P
      0.1471792              1.0000000
Be    P
      0.0558262              1.0000000
Be    D
      2.4645300              1.0000000
Be    D
      0.3587744              1.0000000
Be    D
      0.1399834              1.0000000
Be    D
      0.0744374              1.0000000
Be    F
      1.0663067              1.0000000
Be    F
      0.4427746              1.0000000
Be    F
      0.1896596              1.0000000
Be    G
      0.6293324              1.0000000
Be    G
      0.2806803              1.0000000
end
basis "B_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
B    S
      1.1539420              1.0000000
B    S
      0.2883420              1.0000000
B    S
      0.1113140              1.0000000
B    S
      0.0464270              1.0000000
B    P
      2.3174260              1.0000000
B    P
      0.7609140              1.0000000
B    P
      0.3008240              1.0000000
B    P
      0.1055500              1.0000000
B    D
      2.4470130              1.0000000
B    D
      0.9431480              1.0000000
B    D
      0.3167940              1.0000000
B    D
      0.1098660              1.0000000
B    F
      2.8263180              1.0000000
B    F
      1.5301040              1.0000000
B    F
      0.4936850              1.0000000
B    G
      1.1485200              1.0000000
B    G
      0.4541790              1.0000000
end
basis "C_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
C    S
      1.7762210              1.0000000
C    S
      0.4348300              1.0000000
C    S
      0.1700680              1.0000000
C    S
      0.0628640              1.0000000
C    P
      3.5443660              1.0000000
C    P
      1.2364760              1.0000000
C    P
      0.4330690              1.0000000
C    P
      0.1510190              1.0000000
C    D
      5.3140410              1.0000000
C    D
      1.4755160              1.0000000
C    D
      0.4511130              1.0000000
C    D
      0.1223350              1.0000000
C    F
      3.6496070              1.0000000
C    F
      2.2712110              1.0000000
C    F
      0.6532090              1.0000000
C    G
      1.7488910              1.0000000
C    G
      0.6757530              1.0000000
end
basis "N_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
N    S
      2.5142530              1.0000000
N    S
      0.6195460              1.0000000
N    S
      0.2368770              1.0000000
N    S
      0.0827950              1.0000000
N    P
      5.1433850              1.0000000
N    P
      1.7680390              1.0000000
N    P
      0.6527980              1.0000000
N    P
      0.2350680              1.0000000
N    D
      8.4417550              1.0000000
N    D
      2.0351560              1.0000000
N    D
      0.5308650              1.0000000
N    D
      0.1656730              1.0000000
N    F
      5.7586400              1.0000000
N    F
      3.4621280              1.0000000
N    F
      0.7008700              1.0000000
N    G
      2.4582280              1.0000000
N    G
      0.9114720              1.0000000
end
basis "O_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
O    S
      3.2774940              1.0000000
O    S
      0.8666210              1.0000000
O    S
      0.3115360              1.0000000
O    S
      0.1052510              1.0000000
O    P
      6.6784410              1.0000000
O    P
      2.2948200              1.0000000
O    P
      0.7940390              1.0000000
O    P
      0.2937650              1.0000000
O    D
     10.4260680              1.0000000
O    D
      1.8599080              1.0000000
O    D
      0.7656230              1.0000000
O    D
      0.1975180              1.0000000
O    F
      6.7272830              1.0000000
O    F
      3.3043080              1.0000000
O    F
      0.9566660              1.0000000
O    G
      3.4281350              1.0000000
O    G
      1.1889410              1.0000000
end
basis "F_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
F    S
      4.2323880              1.0000000
F    S
      1.2231830              1.0000000
F    S
      0.4238710              1.0000000
F    S
      0.1424070              1.0000000
F    P
      8.7998160              1.0000000
F    P
      2.9240990              1.0000000
F    P
      1.1141630              1.0000000
F    P
      0.4006190              1.0000000
F    D
     13.3136190              1.0000000
F    D
      2.2073530              1.0000000
F    D
      0.9286690              1.0000000
F    D
      0.2032470              1.0000000
F    F
      5.6156240              1.0000000
F    F
      3.7961450              1.0000000
F    F
      1.2629600              1.0000000
F    G
      4.3166380              1.0000000
F    G
      1.4551000              1.0000000
end
basis "Ne_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Ne    S
      5.6009450              1.0000000
Ne    S
      1.3483520              1.0000000
Ne    S
      0.6002040              1.0000000
Ne    S
      0.1570870              1.0000000
Ne    P
     15.0356100              1.0000000
Ne    P
      3.7159880              1.0000000
Ne    P
      1.3697440              1.0000000
Ne    P
      0.4606930              1.0000000
Ne    D
     24.9202910              1.0000000
Ne    D
      3.0080320              1.0000000
Ne    D
      0.9917010              1.0000000
Ne    D
      0.3198690              1.0000000
Ne    F
      9.7432740              1.0000000
Ne    F
      6.5021880              1.0000000
Ne    F
      2.7188800              1.0000000
Ne    G
      5.0236930              1.0000000
Ne    G
      1.7095220              1.0000000
end
basis "Na_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Na    S
      0.3023291              1.0000000
Na    S
      0.2260291              1.0000000
Na    S
      0.0496470              1.0000000
Na    S
      0.0114234              1.0000000
Na    P
      3.9449727              1.0000000
Na    P
      0.2577999              1.0000000
Na    P
      0.0456907              1.0000000
Na    P
      0.0197746              1.0000000
Na    D
      5.6748225              1.0000000
Na    D
      0.4398375              1.0000000
Na    D
      0.3158845              1.0000000
Na    D
      0.0674100              1.0000000
Na    F
      0.4993634              1.0000000
Na    F
      0.3153051              1.0000000
Na    F
      0.0968878              1.0000000
Na    G
      0.7776060              1.0000000
Na    G
      0.4739351              1.0000000
end
basis "Mg_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Mg    S
      0.4865599              1.0000000
Mg    S
      0.1084766              1.0000000
Mg    S
      0.0523547              1.0000000
Mg    S
      0.0235463              1.0000000
Mg    P
      6.3173557              1.0000000
Mg    P
      0.4238647              1.0000000
Mg    P
      0.0939448              1.0000000
Mg    P
      0.0310785              1.0000000
Mg    D
      3.0026948              1.0000000
Mg    D
      0.6091932              1.0000000
Mg    D
      0.3794731              1.0000000
Mg    D
      0.1010276              1.0000000
Mg    F
      1.2589009              1.0000000
Mg    F
      0.2936068              1.0000000
Mg    F
      0.1418959              1.0000000
Mg    G
      0.3813321              1.0000000
Mg    G
      0.1973197              1.0000000
end
basis "Al_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Al    S
      0.8937540              1.0000000
Al    S
      0.1702740              1.0000000
Al    S
      0.0777620              1.0000000
Al    S
      0.0303530              1.0000000
Al    P
      3.7867580              1.0000000
Al    P
      0.5096630              1.0000000
Al    P
      0.1705860              1.0000000
Al    P
      0.0653200              1.0000000
Al    D
      5.0930530              1.0000000
Al    D
      1.1858500              1.0000000
Al    D
      0.3880950              1.0000000
Al    D
      0.1552920              1.0000000
Al    F
      1.5224060              1.0000000
Al    F
      0.8711090              1.0000000
Al    F
      0.2478290              1.0000000
Al    G
      0.5003810              1.0000000
Al    G
      0.2433830              1.0000000
end
basis "Si_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Si    S
      1.1735420              1.0000000
Si    S
      0.2464220              1.0000000
Si    S
      0.1059410              1.0000000
Si    S
      0.0420280              1.0000000
Si    P
      7.2034020              1.0000000
Si    P
      1.0547700              1.0000000
Si    P
      0.2296670              1.0000000
Si    P
      0.0858680              1.0000000
Si    D
     13.8978640              1.0000000
Si    D
      1.8529670              1.0000000
Si    D
      0.5342380              1.0000000
Si    D
      0.2085970              1.0000000
Si    F
      2.6386300              1.0000000
Si    F
      1.0873250              1.0000000
Si    F
      0.3308400              1.0000000
Si    G
      0.6679210              1.0000000
Si    G
      0.3232410              1.0000000
end
basis "P_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
P    S
      1.4444940              1.0000000
P    S
      0.3327610              1.0000000
P    S
      0.1470150              1.0000000
P    S
      0.0547690              1.0000000
P    P
      8.8333920              1.0000000
P    P
      1.4292580              1.0000000
P    P
      0.3455270              1.0000000
P    P
      0.1227020              1.0000000
P    D
     23.8442280              1.0000000
P    D
      2.5708770              1.0000000
P    D
      0.7505300              1.0000000
P    D
      0.2728740              1.0000000
P    F
      2.6386300              1.0000000
P    F
      1.0873250              1.0000000
P    F
      0.3308400              1.0000000
P    G
      0.8655790              1.0000000
P    G
      0.4195210              1.0000000
end
basis "S_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
S    S
      1.7191530              1.0000000
S    S
      0.4251920              1.0000000
S    S
      0.1916440              1.0000000
S    S
      0.0781390              1.0000000
S    P
      7.5030310              1.0000000
S    P
      1.6650230              1.0000000
S    P
      0.3658120              1.0000000
S    P
      0.1511070              1.0000000
S    D
     38.7211670              1.0000000
S    D
      4.5339680              1.0000000
S    D
      0.9039240              1.0000000
S    D
      0.3907930              1.0000000
S    F
      4.5971550              1.0000000
S    F
      1.1422300              1.0000000
S    F
      0.4155190              1.0000000
S    G
      1.0509280              1.0000000
S    G
      0.5003150              1.0000000
end
basis "Cl_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Cl    S
      2.0243350              1.0000000
Cl    S
      0.5244490              1.0000000
Cl    S
      0.2350910              1.0000000
Cl    S
      0.0911080              1.0000000
Cl    P
      8.4553600              1.0000000
Cl    P
      1.8149770              1.0000000
Cl    P
      0.4467550              1.0000000
Cl    P
      0.1833440              1.0000000
Cl    D
     45.0759920              1.0000000
Cl    D
      5.2972180              1.0000000
Cl    D
      1.1491190              1.0000000
Cl    D
      0.3906120              1.0000000
Cl    F
      5.9052100              1.0000000
Cl    F
      1.2939260              1.0000000
Cl    F
      0.4921850              1.0000000
Cl    G
      1.2759340              1.0000000
Cl    G
      0.6004520              1.0000000
end
basis "Ar_cc-pVTZ-F12-OPTRI" SPHERICAL 
#basis SET: (4s,4p,4d,3f,2g) -> [4s,4p,4d,3f,2g]
Ar    S
      2.3765470              1.0000000
Ar    S
      0.6337930              1.0000000
Ar    S
      0.2830930              1.0000000
Ar    S
      0.1049720              1.0000000
Ar    P
      9.4622090              1.0000000
Ar    P
      1.9950640              1.0000000
Ar    P
      0.4984010              1.0000000
Ar    P
      0.1930500              1.0000000
Ar    D
     52.8161270              1.0000000
Ar    D
      7.8069000              1.0000000
Ar    D
      1.3518420              1.0000000
Ar    D
      0.5391840              1.0000000
Ar    F
      7.2584000              1.0000000
Ar    F
      2.0900430              1.0000000
Ar    F
      0.5969410              1.0000000
Ar    G
      1.5233290              1.0000000
Ar    G
      0.7109950              1.0000000
end
