1
# aug-cc-pVDZ-DK Diffuse EMSL Basis Set Exchange Library 4/15/11 10:04 AM
4
# H : T.H. Dunning, Jr. J. Chem. Phys. 90, 1007 (1989).
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# He : D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
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# B - F: R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96,
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# Al - Cl: D.E. Woon and T.H. Dunning, Jr. J. Chem. Phys. 98, 1358 (1993).
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# Sc - Zn: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)
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# N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 125, 074110 (2006)
15
basis "H_aug-cc-pVDZ-DK Diffuse" SPHERICAL
21
basis "He_aug-cc-pVDZ-DK Diffuse" SPHERICAL
27
basis "Li_aug-cc-pVDZ-DK Diffuse" SPHERICAL
35
basis "Be_aug-cc-pVDZ-DK Diffuse" SPHERICAL
43
basis "B_aug-cc-pVDZ-DK Diffuse" SPHERICAL
51
basis "C_aug-cc-pVDZ-DK Diffuse" SPHERICAL
59
basis "N_aug-cc-pVDZ-DK Diffuse" SPHERICAL
67
basis "O_aug-cc-pVDZ-DK Diffuse" SPHERICAL
75
basis "F_aug-cc-pVDZ-DK Diffuse" SPHERICAL
83
basis "Ne_aug-cc-pVDZ-DK Diffuse" SPHERICAL
91
basis "Na_aug-cc-pVDZ-DK Diffuse" SPHERICAL
99
basis "Mg_aug-cc-pVDZ-DK Diffuse" SPHERICAL
107
basis "Al_aug-cc-pVDZ-DK Diffuse" SPHERICAL
115
basis "Si_aug-cc-pVDZ-DK Diffuse" SPHERICAL
123
basis "P_aug-cc-pVDZ-DK Diffuse" SPHERICAL
131
basis "S_aug-cc-pVDZ-DK Diffuse" SPHERICAL
139
basis "Cl_aug-cc-pVDZ-DK Diffuse" SPHERICAL
147
basis "Ar_aug-cc-pVDZ-DK Diffuse" SPHERICAL
155
basis "Sc_aug-cc-pVDZ-DK Diffuse" SPHERICAL
157
1.110000E-02 1.0000000
159
1.066000E-02 1.0000000
161
1.244000E-02 1.0000000
163
4.063000E-02 1.0000000
165
basis "Ti_aug-cc-pVDZ-DK Diffuse" SPHERICAL
167
1.173000E-02 1.0000000
169
1.172000E-02 1.0000000
171
1.712000E-02 1.0000000
173
8.069000E-02 1.0000000
175
basis "V_aug-cc-pVDZ-DK Diffuse" SPHERICAL
177
1.232000E-02 1.0000000
179
1.240000E-02 1.0000000
181
2.240000E-02 1.0000000
183
1.281300E-01 1.0000000
185
basis "Cr_aug-cc-pVDZ-DK Diffuse" SPHERICAL
187
1.247000E-02 1.0000000
189
1.307000E-02 1.0000000
191
2.498000E-02 1.0000000
193
1.724900E-01 1.0000000
195
basis "Mn_aug-cc-pVDZ-DK Diffuse" SPHERICAL
197
1.335000E-02 1.0000000
199
1.376000E-02 1.0000000
201
2.853000E-02 1.0000000
203
2.176400E-01 1.0000000
205
basis "Fe_aug-cc-pVDZ-DK Diffuse" SPHERICAL
207
1.401000E-02 1.0000000
209
1.401000E-02 1.0000000
211
3.216000E-02 1.0000000
213
2.672300E-01 1.0000000
215
basis "Co_aug-cc-pVDZ-DK Diffuse" SPHERICAL
217
1.459000E-02 1.0000000
219
1.520000E-02 1.0000000
221
3.598000E-02 1.0000000
223
3.204100E-01 1.0000000
225
basis "Ni_aug-cc-pVDZ-DK Diffuse" SPHERICAL
227
1.516000E-02 1.0000000
229
1.494000E-02 1.0000000
231
3.999000E-02 1.0000000
233
3.772500E-01 1.0000000
235
basis "Cu_aug-cc-pVDZ-DK Diffuse" SPHERICAL
237
1.572000E-02 1.0000000
239
1.538000E-02 1.0000000
241
6.489000E-02 1.0000000
243
4.516500E-01 1.0000000
245
basis "Zn_aug-cc-pVDZ-DK Diffuse" SPHERICAL
247
1.623000E-02 1.0000000
249
1.582000E-02 1.0000000
251
8.897000E-02 1.0000000
253
5.365400E-01 1.0000000
255
basis "Ga_aug-cc-pVDZ-DK Diffuse" SPHERICAL
263
basis "Ge_aug-cc-pVDZ-DK Diffuse" SPHERICAL
271
basis "As_aug-cc-pVDZ-DK Diffuse" SPHERICAL
279
basis "Se_aug-cc-pVDZ-DK Diffuse" SPHERICAL
287
basis "Br_aug-cc-pVDZ-DK Diffuse" SPHERICAL
295
basis "Kr_aug-cc-pVDZ-DK Diffuse" SPHERICAL