- Timestamp:
- 11/19/09 11:29:41 (14 years ago)
- Branches:
- master
- Children:
- 38d77eb
- Parents:
- 6650a56
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- 1 edited
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cnteny.f
r6650a56 r32289cd 4 4 ! 5 5 ! Copyright 2005 Frank Eisenmenger, U.H.E. Hansmann, 6 ! Shura Hayryan, Chin-Ku 6 ! Shura Hayryan, Chin-Ku 7 7 ! Copyright 2007 Frank Eisenmenger, U.H.E. Hansmann, 8 8 ! Jan H. Meinke, Sandipan Mohanty … … 20 20 include 'INCL.H' 21 21 22 parameter (coeycn=2.d0) ! min. cont. energy to display 22 double precision coeycn, coey, eyatcn, cqi, xi, yi, zi, xij, yij 23 double precision zij, rij2, rij4, rij6, rij, sr, ep, ey 24 25 integer ieyel, ntlvr, nml, iat1, nat, i, ifivr, i1s, io, iv, ia 26 integer it, ic, i2s, ims, i1, i2, ii, ity, ivw, j, jj, jty, i14 27 integer nbc, ir, nursat, idxat 28 29 parameter (coeycn=2.d0) ! min. cont. energy to display 23 30 24 31 dimension eyatcn(mxat),idxat(mxat)
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