Searched refs:la_max1 (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | debug_os_integrals.F | 401 INTEGER :: i, iax, iay, iaz, ibx, iby, ibz, j, k, l, la_max, la_max1, la_max2, la_min, & local 425 la_max1 = 1 431 ALLOCATE (saabb(ncoset(la_max1), ncoset(la_max2), ncoset(lb_max1), ncoset(lb_max2))) 433 maxl = MAX(la_max1 + la_max2, lb_max1 + lb_max2) 457 la_max = la_max1 + la_max2 475 DO i = ncoset(la_min1 - 1) + 1, ncoset(la_max1) 522 SUBROUTINE overlap_aabb_test(la_max1, la_min1, npgfa1, zeta1, & argument 528 INTEGER, INTENT(IN) :: la_max1, la_min1, npgfa1 local 562 la_max = la_max1 + la_max2 583 DO i = ncoset(la_min1 - 1) + 1, ncoset(la_max1) [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | debug_os_integrals.F | 401 INTEGER :: i, iax, iay, iaz, ibx, iby, ibz, j, k, l, la_max, la_max1, la_max2, la_min, & local 425 la_max1 = 1 431 ALLOCATE (saabb(ncoset(la_max1), ncoset(la_max2), ncoset(lb_max1), ncoset(lb_max2))) 433 maxl = MAX(la_max1 + la_max2, lb_max1 + lb_max2) 457 la_max = la_max1 + la_max2 475 DO i = ncoset(la_min1 - 1) + 1, ncoset(la_max1) 522 SUBROUTINE overlap_aabb_test(la_max1, la_min1, npgfa1, zeta1, & argument 528 INTEGER, INTENT(IN) :: la_max1, la_min1, npgfa1 local 562 la_max = la_max1 + la_max2 583 DO i = ncoset(la_min1 - 1) + 1, ncoset(la_max1) [all …]
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/aobasis/ |
H A D | ai_verfc.F | 172 verf(1:ncoset(la_max1), 1:ncoset(lb_max1), 1) = 0._dp 183 la_max = la_max1 + 1 186 la_max = la_max1 195 la_max = la_max1 225 nap = nap + ncoset(la_max1) !JT 231 na = na + ncoset(la_max1 - maxder_local) !JT 232 nap = nap + ncoset(la_max1) !JT 920 DO i = 1, ncoset(la_max1) !JT 945 DO la = 0, la_max1 1018 na = na + ncoset(la_max1 - maxder_local) !JT [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/aobasis/ |
H A D | ai_verfc.F | 172 verf(1:ncoset(la_max1), 1:ncoset(lb_max1), 1) = 0._dp 183 la_max = la_max1 + 1 186 la_max = la_max1 195 la_max = la_max1 225 nap = nap + ncoset(la_max1) !JT 231 na = na + ncoset(la_max1 - maxder_local) !JT 232 nap = nap + ncoset(la_max1) !JT 920 DO i = 1, ncoset(la_max1) !JT 945 DO la = 0, la_max1 1018 na = na + ncoset(la_max1 - maxder_local) !JT [all …]
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