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Can not get the output file,ie *.out but can get other output files like *.std,*.cif Date: 2010/05/02 23:42 Name: Dimpy   <dimpy.sharma@tyndall.ie> Hi, I want to aclcuate the total energy of my system in OPEN-MX but while running the calculaiton I can get other files but not the *.out file which conatns the total energy and also in the *.std file the calculaiton stops as follwos without giving me the total energy Band_DFT_kpath start kpath 1 (0.000000 0.000000 0.000000)->(0.500000 0.000000 0.000000) <Band_DFT_Dosout> KGrids1: -0.458332 -0.374999 -0.291666 -0.208332 -0.124999 -0.041666 0.041668 0.125001 0.208334 0.291668 0.375001 0.458334 KGrids2: -0.458334 -0.375001 -0.291668 -0.208334 -0.125001 -0.041668 0.041666 0.124999 0.208332 0.291666 0.374999 0.458332 KGrids3: -0.458331 -0.374998 -0.291665 -0.208331 -0.124998 -0.041665 0.041669 0.125002 0.208335 0.291669 0.375002 0.458335 iemin and iemax= 1 350 write eigenvalues write eigenvectors Band_DFT_MO start kpoint=1 /1 <MD= 1> Force calculation Force calculation #1 Force calculation #2 Force calculation #3 Force calculation #4 Force calculation #5 <MD= 1> Total Energy Force calculation #6 Force calculation #7 Can any one please help me . Thanks Dimpy

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