/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/eomccsdtq/ |
H A D | eomccsdtq_y4_4.F | 1 SUBROUTINE eomccsdtq_y4_4(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_of argument 17 INTEGER d_c 170 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 202 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 212 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 222 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - [all …]
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H A D | eomccsdtq_x4_8_8.F | 1 SUBROUTINE eomccsdtq_x4_8_8(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_ argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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H A D | eomccsdtq_x4_14_5.F | 1 SUBROUTINE eomccsdtq_x4_14_5(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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H A D | eomccsdtq_y1_20_6.F | 1 SUBROUTINE eomccsdtq_y1_20_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 166 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 177 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 188 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 210 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 231 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | eomccsdtq_y1_20_7.F | 1 SUBROUTINE eomccsdtq_y1_20_7(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 165 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 176 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 187 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 198 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 229 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 240 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | eomccsdtq_x4_8_6.F | 1 SUBROUTINE eomccsdtq_x4_8_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_ argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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H A D | eomccsdtq_y4_12.F | 1 SUBROUTINE eomccsdtq_y4_12(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_o argument 17 INTEGER d_c 168 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 178 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 188 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 198 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 208 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 218 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 228 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 238 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - [all …]
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H A D | eomccsdtq_y4_2.F | 1 SUBROUTINE eomccsdtq_y4_2(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_of argument 17 INTEGER d_c 143 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 153 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 163 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 173 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 183 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 193 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 203 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 213 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/eomccsdtq/ |
H A D | eomccsdtq_y4_3.F | 1 SUBROUTINE eomccsdtq_y4_3(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_of argument 17 INTEGER d_c 171 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 181 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - 243 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p3b - [all …]
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H A D | eomccsdtq_y4_4.F | 1 SUBROUTINE eomccsdtq_y4_4(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_of argument 17 INTEGER d_c 170 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 202 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 212 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 222 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p2b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(p4b - [all …]
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H A D | eomccsdtq_x4_14_5.F | 1 SUBROUTINE eomccsdtq_x4_14_5(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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H A D | eomccsdtq_x4_8_6.F | 1 SUBROUTINE eomccsdtq_x4_8_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_ argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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H A D | eomccsdtq_y1_20_6.F | 1 SUBROUTINE eomccsdtq_y1_20_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 166 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 177 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 188 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 210 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 231 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | eomccsdtq_y1_20_7.F | 1 SUBROUTINE eomccsdtq_y1_20_7(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c argument 17 INTEGER d_c 165 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 176 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 187 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 198 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 229 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 240 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | eomccsdtq_x4_8_8.F | 1 SUBROUTINE eomccsdtq_x4_8_8(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_ argument 17 INTEGER d_c 159 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 169 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 180 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 191 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 201 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 211 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 232 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/ccsdtq_lambda/ |
H A D | ccsdtq_lambda1_21_6.F | 1 SUBROUTINE ccsdtq_lambda1_21_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k argument 17 INTEGER d_c 166 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 177 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 188 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 210 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 231 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | ccsdtq_lambda1_21_7.F | 1 SUBROUTINE ccsdtq_lambda1_21_7(d_a,k_a_offset,d_b,k_b_offset,d_c,k argument 17 INTEGER d_c 165 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 176 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 187 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 198 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 229 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 240 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/ccsdtq/ |
H A D | ccsdtq_t4_8_6.F | 1 SUBROUTINE ccsdtq_t4_8_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_off argument 17 INTEGER d_c 157 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 167 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 178 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 189 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 230 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/ccsdtq/ |
H A D | ccsdtq_t4_8_6.F | 1 SUBROUTINE ccsdtq_t4_8_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_off argument 17 INTEGER d_c 157 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 167 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 178 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 189 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - 230 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h4b - [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/ccsdtq_lambda/ |
H A D | ccsdtq_lambda1_21_6.F | 1 SUBROUTINE ccsdtq_lambda1_21_6(d_a,k_a_offset,d_b,k_b_offset,d_c,k argument 17 INTEGER d_c 166 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 177 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 188 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 199 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 210 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 221 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 231 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 242 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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H A D | ccsdtq_lambda1_21_7.F | 1 SUBROUTINE ccsdtq_lambda1_21_7(d_a,k_a_offset,d_b,k_b_offset,d_c,k argument 17 INTEGER d_c 165 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 176 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 187 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 198 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 209 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 219 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 229 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b 240 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h17b [all …]
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/mrcc/ccsd/ |
H A D | T2_pg_C2.F | 50 SUBROUTINE T2_pg_C2_1(d_a,k_a_offset,d_c,k_c_offset,coef) argument 64 INTEGER d_c 128 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 148 SUBROUTINE T2_pg_C2_2(d_a,k_a_offset,d_b,k_b_offset,d_c, argument 166 INTEGER d_c 306 SUBROUTINE T2_pg_C2_2_1(d_a,k_a_offset,d_c,k_c_offset) argument 320 INTEGER d_c 445 SUBROUTINE T2_pg_C2_2_2(d_a,k_a_offset,d_c,k_c_offset) argument 459 INTEGER d_c 528 SUBROUTINE T2_pg_C2_3(d_a,k_a_offset,d_c,k_c_offset,coef) argument [all …]
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H A D | T2_C2.F | 51 SUBROUTINE T2_C2_1(d_a,k_a_offset,d_c,k_c_offset,coef) argument 64 INTEGER d_c 128 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 148 SUBROUTINE T2_C2_2(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_offset, argument 165 INTEGER d_c 305 SUBROUTINE T2_C2_2_1(d_a,k_a_offset,d_c,k_c_offset) argument 318 INTEGER d_c 442 SUBROUTINE T2_C2_2_2(d_a,k_a_offset,d_c,k_c_offset) argument 455 INTEGER d_c 524 SUBROUTINE T2_C2_3(d_a,k_a_offset,d_c,k_c_offset,coef) argument [all …]
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/tce/cr-eomccsd_t/ |
H A D | t2t12.F | 24 SUBROUTINE t2t12_1(d_a,k_a_offset,d_c,k_c_offset) argument 37 INTEGER d_c 100 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 120 SUBROUTINE t2t12_2(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_offset) argument 135 INTEGER d_c 231 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 239 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h1b - 310 SUBROUTINE t2t12_act_1(d_a,k_a_offset,d_c,k_c_offset) argument 323 INTEGER d_c 411 &d_c,k_c_offset) [all …]
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/tce/mrcc/ccsd/ |
H A D | T2_C2.F | 51 SUBROUTINE T2_C2_1(d_a,k_a_offset,d_c,k_c_offset,coef) argument 64 INTEGER d_c 128 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h2b - 148 SUBROUTINE T2_C2_2(d_a,k_a_offset,d_b,k_b_offset,d_c,k_c_offset, argument 165 INTEGER d_c 305 SUBROUTINE T2_C2_2_1(d_a,k_a_offset,d_c,k_c_offset) argument 318 INTEGER d_c 442 SUBROUTINE T2_C2_2_2(d_a,k_a_offset,d_c,k_c_offset) argument 455 INTEGER d_c 524 SUBROUTINE T2_C2_3(d_a,k_a_offset,d_c,k_c_offset,coef) argument [all …]
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