source: tests/regression/Parser/Tremolo-Potentials/pre/argon.potentials

Candidate_v1.6.1
Last change on this file was 4217e7, checked in by Frederik Heber <heber@…>, 14 years ago

Added regression test on --parse-tremolo-potentials.

  • Property mode set to 100644
File size: 327 bytes
Line 
1particles {
2 particle: particle_type=Argon, element_name=Ar, sigma=1.000000e+00, epsilon=1.000000e+00, sigma14=1.000000e+00, epsilon14=1.000000e+00, mass=1.000000e+00, free=3, charge=0.000000e+00;
3 };
4nonbonded_2body_potentials {
5 ljspline: particle_type1=Argon, particle_type2=Argon, r_cut=2.300000e+00, r_l=1.900000e+00;
6 };
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