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2017-02-09 02:13:34 +01:00
input_qxyz.dat first working version 2013-01-09 23:46:49 +01:00
input_random1000.dat example system of 1000 positively charged random particles in unitbox 2015-04-17 16:45:47 +02:00
input_silicamelt.dat new testcase silicamelt 2013-07-02 22:05:10 +02:00
input_silicamelt_12960.dat 12960 particles of silica melt 2017-02-07 17:37:14 +01:00
input_tu_cubic_285119.dat the new testcase from Thomas Ullmann 2016-03-11 17:01:54 +01:00
input_tu_cubic_285119.wrapped.dat wrapped particles on the simulation box boundaries 2016-03-12 04:19:23 +01:00
input_tu_cubic_285119.wrapped2.dat wrapped particles on the simulation box boundaries, without loss of coordinate precision 2016-03-16 17:18:00 +01:00
madelung8.dat add the probing point at 1/6,1/6,1/6 2013-09-19 13:49:06 +02:00
qxyz_NaCl444.dat NaCl from 4x4x4 base boxes 2014-04-11 20:57:35 +02:00
qxyz_NaCl_25_25_25.dat NaCl from 25x25x25 base boxes 2014-04-11 20:59:08 +02:00
reference_long_double.dat long double reference solution 2013-03-18 17:10:56 +01:00
reference_random1000.dat example system of 1000 positively charged random particles in unitbox 2015-04-17 16:45:47 +02:00
reference_silicamelt.dat new testcase silicamelt 2013-07-02 22:05:10 +02:00
reference_silicamelt.periodic.dat periodic reference solution for input_silicamelt.dat (from coulomb, with dipole compensation) 2016-03-14 21:23:55 +01:00
reference_silicamelt.periodic.nodipolecomp.dat periodic reference solution for input_silicamelt.dat (from fmmtest, no dipole compensation) 2016-03-13 20:46:31 +01:00
reference_silicamelt_12960.open.float128.dat open boundary reference solution for silicamelt_12960 2017-02-07 17:43:22 +01:00
reference_silicamelt_12960.periodic3d.float128.dat 3d-periodic reference solution for silicamelt_12960 2017-02-07 19:29:31 +01:00
reference_silicamelt_12960.periodic3d.scafacos.dat 12960 particles of silica melt 2017-02-07 17:37:14 +01:00
reference_tu_cubic_285119.dat the new testcase from Thomas Ullmann 2016-03-11 17:01:54 +01:00
reference_tu_cubic_285119.wrapped.dat wrapped particles on the simulation box boundaries 2016-03-12 04:19:23 +01:00
reference_tu_cubic_285119.wrapped.periodic.dat periodic reference solution for input_tu_cubic_285119.wrapped.dat (from coulomb, with dipole compensation) 2016-03-14 21:25:54 +01:00
reference_tu_cubic_285119.wrapped.periodic.nodipolecomp.dat periodic reference solution for input_tu_cubic_285119.wrapped.dat (from fmmtest, no dipole compensation) 2016-03-13 20:45:46 +01:00
reference_tu_cubic_285119.wrapped2.nonperiodic.dat wrapped particles on the simulation box boundaries, without loss of coordinate precision 2016-03-16 17:18:00 +01:00
reference_tu_cubic_285119.wrapped2.periodic.dat periodic reference solution for input_tu_cubic_285119.wrapped2.dat (from coulomb, with dipole compensation) 2016-03-24 13:15:01 +01:00
run_fmmtest.coulexpl_114537.open add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.random_1000.open add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.silicamelt_12960.open add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.silicamelt_12960.periodic3d add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.silicamelt_103680.open add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.silicamelt_103680.periodic3d add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.TehA_cubic_285119.open add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00
run_fmmtest.TehA_cubic_285119.periodic3d add run_fmmmtest.* scripts setting input, reference, UNITBOX, CENTER 2017-02-09 02:13:34 +01:00