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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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