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/dports/science/simint/simint-v0.8/simint/ostei/gen/
H A Dostei_d_s_h_d.c468 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_h_d()
469 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_h_d()
470 P_tmp.AB_x = P_AB; in ostei_s_d_h_d()
471 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_h_d()
476 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_h_d()
477 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_h_d()
478 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_h_d()
546 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_d_h()
547 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_d_h()
548 P_tmp.AB_x = P_AB; in ostei_s_d_d_h()
[all …]
H A Dostei_d_s_i_d.c463 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_i_d()
464 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_i_d()
465 P_tmp.AB_x = P_AB; in ostei_s_d_i_d()
466 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_i_d()
471 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_i_d()
472 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_i_d()
473 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_i_d()
541 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_d_i()
542 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_d_i()
543 P_tmp.AB_x = P_AB; in ostei_s_d_d_i()
[all …]
H A Dostei_d_s_i_f.c504 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_i_f()
505 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_i_f()
506 P_tmp.AB_x = P_AB; in ostei_s_d_i_f()
507 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_i_f()
512 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_i_f()
513 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_i_f()
514 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_i_f()
582 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_f_i()
583 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_f_i()
584 P_tmp.AB_x = P_AB; in ostei_s_d_f_i()
[all …]
H A Dostei_f_p_j_s.c476 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_f_k_s()
477 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_f_k_s()
478 P_tmp.AB_x = P_AB; in ostei_p_f_k_s()
479 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_f_k_s()
484 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_f_k_s()
485 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_f_k_s()
486 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_f_k_s()
554 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_f_s_k()
555 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_f_s_k()
556 P_tmp.AB_x = P_AB; in ostei_p_f_s_k()
[all …]
H A Dostei_g_d_d_s.c474 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_d_g_d_s()
475 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_d_g_d_s()
476 P_tmp.AB_x = P_AB; in ostei_d_g_d_s()
477 P_tmp.AB_y = P_AB + P.nshell12; in ostei_d_g_d_s()
482 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_d_g_d_s()
483 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_d_g_d_s()
484 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_d_g_d_s()
552 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_d_g_s_d()
553 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_d_g_s_d()
554 P_tmp.AB_x = P_AB; in ostei_d_g_s_d()
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H A Dostei_d_p_h_s.c479 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_h_s()
480 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_h_s()
481 P_tmp.AB_x = P_AB; in ostei_p_d_h_s()
482 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_d_h_s()
487 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_d_h_s()
488 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_d_h_s()
489 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_d_h_s()
557 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_s_h()
558 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_s_h()
559 P_tmp.AB_x = P_AB; in ostei_p_d_s_h()
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H A Dostei_d_s_g_d.c474 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_g_d()
475 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_g_d()
476 P_tmp.AB_x = P_AB; in ostei_s_d_g_d()
477 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_g_d()
482 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_g_d()
483 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_g_d()
484 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_g_d()
552 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_d_g()
553 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_d_g()
554 P_tmp.AB_x = P_AB; in ostei_s_d_d_g()
[all …]
H A Dostei_d_s_j_d.c466 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_k_d()
467 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_k_d()
468 P_tmp.AB_x = P_AB; in ostei_s_d_k_d()
469 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_k_d()
474 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_k_d()
475 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_k_d()
476 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_k_d()
544 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_d_k()
545 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_d_k()
546 P_tmp.AB_x = P_AB; in ostei_s_d_d_k()
[all …]
H A Dostei_d_s_j_f.c507 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_k_f()
508 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_k_f()
509 P_tmp.AB_x = P_AB; in ostei_s_d_k_f()
510 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_d_k_f()
515 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_d_k_f()
516 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_d_k_f()
517 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_d_k_f()
585 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_d_f_k()
586 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_d_f_k()
587 P_tmp.AB_x = P_AB; in ostei_s_d_f_k()
[all …]
H A Dostei_f_p_i_s.c478 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_f_i_s()
479 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_f_i_s()
480 P_tmp.AB_x = P_AB; in ostei_p_f_i_s()
481 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_f_i_s()
486 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_f_i_s()
487 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_f_i_s()
488 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_f_i_s()
556 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_f_s_i()
557 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_f_s_i()
558 P_tmp.AB_x = P_AB; in ostei_p_f_s_i()
[all …]
H A Dostei_g_f_p_s.c473 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_g_p_s()
474 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_g_p_s()
475 P_tmp.AB_x = P_AB; in ostei_f_g_p_s()
476 P_tmp.AB_y = P_AB + P.nshell12; in ostei_f_g_p_s()
481 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_f_g_p_s()
482 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_f_g_p_s()
483 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_f_g_p_s()
551 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_g_s_p()
552 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_g_s_p()
553 P_tmp.AB_x = P_AB; in ostei_f_g_s_p()
[all …]
H A Dostei_g_s_f_s.c465 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_g_f_s()
466 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_g_f_s()
467 P_tmp.AB_x = P_AB; in ostei_s_g_f_s()
468 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_g_f_s()
473 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_g_f_s()
474 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_g_f_s()
475 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_g_f_s()
517 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_g_s_f()
518 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_g_s_f()
519 P_tmp.AB_x = P_AB; in ostei_s_g_s_f()
[all …]
H A Dostei_d_p_i_s.c477 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_i_s()
478 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_i_s()
479 P_tmp.AB_x = P_AB; in ostei_p_d_i_s()
480 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_d_i_s()
485 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_d_i_s()
486 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_d_i_s()
487 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_d_i_s()
555 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_s_i()
556 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_s_i()
557 P_tmp.AB_x = P_AB; in ostei_p_d_s_i()
[all …]
H A Dostei_d_p_j_s.c472 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_k_s()
473 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_k_s()
474 P_tmp.AB_x = P_AB; in ostei_p_d_k_s()
475 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_d_k_s()
480 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_d_k_s()
481 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_d_k_s()
482 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_d_k_s()
550 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_d_s_k()
551 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_d_s_k()
552 P_tmp.AB_x = P_AB; in ostei_p_d_s_k()
[all …]
H A Dostei_i_g_p_s.c506 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_g_i_p_s()
507 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_g_i_p_s()
508 P_tmp.AB_x = P_AB; in ostei_g_i_p_s()
509 P_tmp.AB_y = P_AB + P.nshell12; in ostei_g_i_p_s()
514 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_g_i_p_s()
515 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_g_i_p_s()
516 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_g_i_p_s()
584 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_g_i_s_p()
585 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_g_i_s_p()
586 P_tmp.AB_x = P_AB; in ostei_g_i_s_p()
[all …]
H A Dostei_i_s_d_p.c476 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_i_d_p()
477 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_i_d_p()
478 P_tmp.AB_x = P_AB; in ostei_s_i_d_p()
479 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_i_d_p()
484 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_i_d_p()
485 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_i_d_p()
486 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_i_d_p()
554 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_i_p_d()
555 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_i_p_d()
556 P_tmp.AB_x = P_AB; in ostei_s_i_p_d()
[all …]
H A Dostei_j_d_f_s.c503 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_d_k_f_s()
504 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_d_k_f_s()
505 P_tmp.AB_x = P_AB; in ostei_d_k_f_s()
506 P_tmp.AB_y = P_AB + P.nshell12; in ostei_d_k_f_s()
511 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_d_k_f_s()
512 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_d_k_f_s()
513 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_d_k_f_s()
581 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_d_k_s_f()
582 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_d_k_s_f()
583 P_tmp.AB_x = P_AB; in ostei_d_k_s_f()
[all …]
H A Dostei_h_s_d_p.c478 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_h_d_p()
479 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_h_d_p()
480 P_tmp.AB_x = P_AB; in ostei_s_h_d_p()
481 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_h_d_p()
486 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_h_d_p()
487 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_h_d_p()
488 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_h_d_p()
556 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_h_p_d()
557 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_h_p_d()
558 P_tmp.AB_x = P_AB; in ostei_s_h_p_d()
[all …]
H A Dostei_i_p_f_s.c465 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_i_f_s()
466 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_i_f_s()
467 P_tmp.AB_x = P_AB; in ostei_p_i_f_s()
468 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_i_f_s()
473 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_i_f_s()
474 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_i_f_s()
475 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_i_f_s()
543 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_i_s_f()
544 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_i_s_f()
545 P_tmp.AB_x = P_AB; in ostei_p_i_s_f()
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H A Dostei_i_s_f_p.c478 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_i_f_p()
479 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_i_f_p()
480 P_tmp.AB_x = P_AB; in ostei_s_i_f_p()
481 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_i_f_p()
486 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_i_f_p()
487 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_i_f_p()
488 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_i_f_p()
556 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_i_p_f()
557 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_i_p_f()
558 P_tmp.AB_x = P_AB; in ostei_s_i_p_f()
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H A Dostei_h_f_p_s.c464 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_h_p_s()
465 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_h_p_s()
466 P_tmp.AB_x = P_AB; in ostei_f_h_p_s()
467 P_tmp.AB_y = P_AB + P.nshell12; in ostei_f_h_p_s()
472 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_f_h_p_s()
473 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_f_h_p_s()
474 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_f_h_p_s()
542 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_h_s_p()
543 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_h_s_p()
544 P_tmp.AB_x = P_AB; in ostei_f_h_s_p()
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H A Dostei_h_p_f_s.c467 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_h_f_s()
468 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_h_f_s()
469 P_tmp.AB_x = P_AB; in ostei_p_h_f_s()
470 P_tmp.AB_y = P_AB + P.nshell12; in ostei_p_h_f_s()
475 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_p_h_f_s()
476 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_p_h_f_s()
477 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_p_h_f_s()
545 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_p_h_s_f()
546 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_p_h_s_f()
547 P_tmp.AB_x = P_AB; in ostei_p_h_s_f()
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H A Dostei_h_s_j_s.c480 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_h_k_s()
481 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_h_k_s()
482 P_tmp.AB_x = P_AB; in ostei_s_h_k_s()
483 P_tmp.AB_y = P_AB + P.nshell12; in ostei_s_h_k_s()
488 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_s_h_k_s()
489 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_s_h_k_s()
490 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_s_h_k_s()
532 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_s_h_s_k()
533 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_s_h_s_k()
534 P_tmp.AB_x = P_AB; in ostei_s_h_s_k()
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H A Dostei_i_f_p_s.c467 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_i_p_s()
468 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_i_p_s()
469 P_tmp.AB_x = P_AB; in ostei_f_i_p_s()
470 P_tmp.AB_y = P_AB + P.nshell12; in ostei_f_i_p_s()
475 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_f_i_p_s()
476 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_f_i_p_s()
477 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_f_i_p_s()
545 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_f_i_s_p()
546 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_f_i_s_p()
547 P_tmp.AB_x = P_AB; in ostei_f_i_s_p()
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H A Dostei_h_g_p_s.c503 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_g_h_p_s()
504 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_g_h_p_s()
505 P_tmp.AB_x = P_AB; in ostei_g_h_p_s()
506 P_tmp.AB_y = P_AB + P.nshell12; in ostei_g_h_p_s()
511 P_tmp.AB_x[i] = -P.AB_x[i]; in ostei_g_h_p_s()
512 P_tmp.AB_y[i] = -P.AB_y[i]; in ostei_g_h_p_s()
513 P_tmp.AB_z[i] = -P.AB_z[i]; in ostei_g_h_p_s()
581 P_tmp.PA_x = P.PB_x; P_tmp.PA_y = P.PB_y; P_tmp.PA_z = P.PB_z; in ostei_g_h_s_p()
582 P_tmp.PB_x = P.PA_x; P_tmp.PB_y = P.PA_y; P_tmp.PB_z = P.PA_z; in ostei_g_h_s_p()
583 P_tmp.AB_x = P_AB; in ostei_g_h_s_p()
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