1 SUBROUTINE ccsdt_lr_beta_2_8_30(d_a,k_a_offset,d_b,k_b_offset,d_c, 2 &k_c_offset) 3C $Id$ 4C This is a Fortran77 program generated by Tensor Contraction Engine v.1.0 5C Copyright (c) Battelle & Pacific Northwest National Laboratory (2002) 6C i1 ( p11 p12 h14 h15 )_ytrbtrat + = -1/3 * t ( p11 h15 )_t * i2 ( p12 h14 )_ytrbtra 7 IMPLICIT NONE 8#include "global.fh" 9#include "mafdecls.fh" 10#include "sym.fh" 11#include "errquit.fh" 12#include "tce.fh" 13 INTEGER d_a 14 INTEGER k_a_offset 15 INTEGER d_b 16 INTEGER k_b_offset 17 INTEGER d_c 18 INTEGER k_c_offset 19 INTEGER nxtask 20 INTEGER next 21 INTEGER nprocs 22 INTEGER count 23 INTEGER p11b 24 INTEGER p12b 25 INTEGER h15b 26 INTEGER h14b 27 INTEGER dimc 28 INTEGER l_c_sort 29 INTEGER k_c_sort 30 INTEGER p11b_1 31 INTEGER h15b_1 32 INTEGER p12b_2 33 INTEGER h14b_2 34 INTEGER dim_common 35 INTEGER dima_sort 36 INTEGER dima 37 INTEGER dimb_sort 38 INTEGER dimb 39 INTEGER l_a_sort 40 INTEGER k_a_sort 41 INTEGER l_a 42 INTEGER k_a 43 INTEGER l_b_sort 44 INTEGER k_b_sort 45 INTEGER l_b 46 INTEGER k_b 47 INTEGER l_c 48 INTEGER k_c 49 EXTERNAL nxtask 50 nprocs = GA_NNODES() 51 count = 0 52 next = nxtask(nprocs,1) 53 DO p11b = noab+1,noab+nvab 54 DO p12b = noab+1,noab+nvab 55 DO h15b = 1,noab 56 DO h14b = 1,noab 57 IF (next.eq.count) THEN 58 IF ((.not.restricted).or.(int_mb(k_spin+p11b-1)+int_mb(k_spin+p12b 59 &-1)+int_mb(k_spin+h14b-1)+int_mb(k_spin+h15b-1).ne.8)) THEN 60 IF (int_mb(k_spin+p11b-1)+int_mb(k_spin+p12b-1) .eq. int_mb(k_spin 61 &+h14b-1)+int_mb(k_spin+h15b-1)) THEN 62 IF (ieor(int_mb(k_sym+p11b-1),ieor(int_mb(k_sym+p12b-1),ieor(int_m 63 &b(k_sym+h14b-1),int_mb(k_sym+h15b-1)))) .eq. ieor(irrep_y,ieor(irr 64 &ep_trb,ieor(irrep_tra,irrep_t)))) THEN 65 dimc = int_mb(k_range+p11b-1) * int_mb(k_range+p12b-1) * int_mb(k_ 66 &range+h14b-1) * int_mb(k_range+h15b-1) 67 IF (.not.MA_PUSH_GET(mt_dbl,dimc,'noname',l_c_sort,k_c_sort)) CALL 68 & ERRQUIT('ccsdt_lr_beta_2_8_30',0,MA_ERR) 69 CALL DFILL(dimc,0.0d0,dbl_mb(k_c_sort),1) 70 IF (int_mb(k_spin+p11b-1) .eq. int_mb(k_spin+h15b-1)) THEN 71 IF (ieor(int_mb(k_sym+p11b-1),int_mb(k_sym+h15b-1)) .eq. irrep_t) 72 &THEN 73 CALL TCE_RESTRICTED_2(p11b,h15b,p11b_1,h15b_1) 74 CALL TCE_RESTRICTED_2(p12b,h14b,p12b_2,h14b_2) 75 dim_common = 1 76 dima_sort = int_mb(k_range+p11b-1) * int_mb(k_range+h15b-1) 77 dima = dim_common * dima_sort 78 dimb_sort = int_mb(k_range+p12b-1) * int_mb(k_range+h14b-1) 79 dimb = dim_common * dimb_sort 80 IF ((dima .gt. 0) .and. (dimb .gt. 0)) THEN 81 IF (.not.MA_PUSH_GET(mt_dbl,dima,'noname',l_a_sort,k_a_sort)) CALL 82 & ERRQUIT('ccsdt_lr_beta_2_8_30',1,MA_ERR) 83 IF (.not.MA_PUSH_GET(mt_dbl,dima,'noname',l_a,k_a)) CALL ERRQUIT(' 84 &ccsdt_lr_beta_2_8_30',2,MA_ERR) 85 CALL GET_HASH_BLOCK(d_a,dbl_mb(k_a),dima,int_mb(k_a_offset),(h15b_ 86 &1 - 1 + noab * (p11b_1 - noab - 1))) 87 CALL TCE_SORT_2(dbl_mb(k_a),dbl_mb(k_a_sort),int_mb(k_range+p11b-1 88 &),int_mb(k_range+h15b-1),2,1,1.0d0) 89 IF (.not.MA_POP_STACK(l_a)) CALL ERRQUIT('ccsdt_lr_beta_2_8_30',3, 90 &MA_ERR) 91 IF (.not.MA_PUSH_GET(mt_dbl,dimb,'noname',l_b_sort,k_b_sort)) CALL 92 & ERRQUIT('ccsdt_lr_beta_2_8_30',4,MA_ERR) 93 IF (.not.MA_PUSH_GET(mt_dbl,dimb,'noname',l_b,k_b)) CALL ERRQUIT(' 94 &ccsdt_lr_beta_2_8_30',5,MA_ERR) 95 CALL GET_HASH_BLOCK(d_b,dbl_mb(k_b),dimb,int_mb(k_b_offset),(h14b_ 96 &2 - 1 + noab * (p12b_2 - noab - 1))) 97 CALL TCE_SORT_2(dbl_mb(k_b),dbl_mb(k_b_sort),int_mb(k_range+p12b-1 98 &),int_mb(k_range+h14b-1),2,1,1.0d0) 99 IF (.not.MA_POP_STACK(l_b)) CALL ERRQUIT('ccsdt_lr_beta_2_8_30',6, 100 &MA_ERR) 101 CALL DGEMM('T','N',dima_sort,dimb_sort,dim_common,1.0d0,dbl_mb(k_a 102 &_sort),dim_common,dbl_mb(k_b_sort),dim_common,1.0d0,dbl_mb(k_c_sor 103 &t),dima_sort) 104 IF (.not.MA_POP_STACK(l_b_sort)) CALL ERRQUIT('ccsdt_lr_beta_2_8_3 105 &0',7,MA_ERR) 106 IF (.not.MA_POP_STACK(l_a_sort)) CALL ERRQUIT('ccsdt_lr_beta_2_8_3 107 &0',8,MA_ERR) 108 END IF 109 END IF 110 END IF 111 IF (.not.MA_PUSH_GET(mt_dbl,dimc,'noname',l_c,k_c)) CALL ERRQUIT(' 112 &ccsdt_lr_beta_2_8_30',9,MA_ERR) 113 IF ((p11b .le. p12b) .and. (h14b .le. h15b)) THEN 114 CALL TCE_SORT_4(dbl_mb(k_c_sort),dbl_mb(k_c),int_mb(k_range+h14b-1 115 &),int_mb(k_range+p12b-1),int_mb(k_range+h15b-1),int_mb(k_range+p11 116 &b-1),4,2,1,3,-1.0d0/12.0d0) 117 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h15b 118 &- 1 + noab * (h14b - 1 + noab * (p12b - noab - 1 + nvab * (p11b - 119 &noab - 1))))) 120 END IF 121 IF ((p11b .le. p12b) .and. (h15b .le. h14b)) THEN 122 CALL TCE_SORT_4(dbl_mb(k_c_sort),dbl_mb(k_c),int_mb(k_range+h14b-1 123 &),int_mb(k_range+p12b-1),int_mb(k_range+h15b-1),int_mb(k_range+p11 124 &b-1),4,2,3,1,1.0d0/12.0d0) 125 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 126 &- 1 + noab * (h15b - 1 + noab * (p12b - noab - 1 + nvab * (p11b - 127 &noab - 1))))) 128 END IF 129 IF ((p12b .le. p11b) .and. (h14b .le. h15b)) THEN 130 CALL TCE_SORT_4(dbl_mb(k_c_sort),dbl_mb(k_c),int_mb(k_range+h14b-1 131 &),int_mb(k_range+p12b-1),int_mb(k_range+h15b-1),int_mb(k_range+p11 132 &b-1),2,4,1,3,1.0d0/12.0d0) 133 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h15b 134 &- 1 + noab * (h14b - 1 + noab * (p11b - noab - 1 + nvab * (p12b - 135 &noab - 1))))) 136 END IF 137 IF ((p12b .le. p11b) .and. (h15b .le. h14b)) THEN 138 CALL TCE_SORT_4(dbl_mb(k_c_sort),dbl_mb(k_c),int_mb(k_range+h14b-1 139 &),int_mb(k_range+p12b-1),int_mb(k_range+h15b-1),int_mb(k_range+p11 140 &b-1),2,4,3,1,-1.0d0/12.0d0) 141 CALL ADD_HASH_BLOCK(d_c,dbl_mb(k_c),dimc,int_mb(k_c_offset),(h14b 142 &- 1 + noab * (h15b - 1 + noab * (p11b - noab - 1 + nvab * (p12b - 143 &noab - 1))))) 144 END IF 145 IF (.not.MA_POP_STACK(l_c)) CALL ERRQUIT('ccsdt_lr_beta_2_8_30',10 146 &,MA_ERR) 147 IF (.not.MA_POP_STACK(l_c_sort)) CALL ERRQUIT('ccsdt_lr_beta_2_8_3 148 &0',11,MA_ERR) 149 END IF 150 END IF 151 END IF 152 next = nxtask(nprocs,1) 153 END IF 154 count = count + 1 155 END DO 156 END DO 157 END DO 158 END DO 159 next = nxtask(-nprocs,1) 160 call GA_SYNC() 161 RETURN 162 END 163