Python make_scalar2 Examples

Example #1

File: pair.py Project: khuston/hoomd-blue

    def process_coeff(self, coeff):
        epsilon = coeff['epsilon'];
        sigma = coeff['sigma'];
        alpha = coeff['alpha'];

        lj1 = 4.0 * epsilon * math.pow(sigma, 12.0);
        lj2 = alpha * 4.0 * epsilon * math.pow(sigma, 6.0);
        return hoomd.make_scalar2(lj1, lj2);

Example #2

File: pair.py Project: harperic/hoomd-blue

    def process_coeff(self, coeff):
        epsilon = coeff['epsilon']
        sigma = coeff['sigma']
        alpha = coeff['alpha']

        lj1 = 4.0 * epsilon * math.pow(sigma, 12.0)
        lj2 = alpha * 4.0 * epsilon * math.pow(sigma, 6.0)
        return hoomd.make_scalar2(lj1, lj2)

Example #3

File: pair.py Project: davidsean/Polymer-in-slit

    def process_coeff(self, coeff):
        epsilon = coeff["epsilon"]
        sigma = coeff["sigma"]
        alpha = coeff["alpha"]

        lj1 = 4.0 * epsilon * math.pow(sigma, 12.0)
        lj2 = alpha * 4.0 * epsilon * math.pow(sigma, 6.0)
        return hoomd.make_scalar2(lj1, lj2)

Example #4

    def process_coeff(self, coeff):
        epsilon = coeff['epsilon']
        sigma = coeff['sigma']
        alpha = coeff['alpha']

        lj1 = 4.0 * epsilon * math.pow(sigma, 12.0)
        lj2 = alpha * 4.0 * epsilon * math.pow(sigma, 6.0)
        return hoomd.make_walls_force_shifted_lj_params(
            hoomd.make_scalar2(lj1, lj2), coeff['r_cut'] * coeff['r_cut'],
            coeff['r_extrap'])

Example #5

    def process_coeff(self, coeff):
        k = coeff['k']
        r0 = coeff['r0']

        # set the parameters for the appropriate type
        return hoomd.make_scalar2(k, r0)

Example #6

File: bond.py Project: TaherGhasimakbari/hoomd

    def process_coeff(self, coeff):
        k = coeff['k'];
        r0 = coeff['r0'];

        # set the parameters for the appropriate type
        return hoomd.make_scalar2(k, r0);

Example #7

File: bond.py Project: ndtrung81/hoomd-blue

    def process_coeff(self, coeff):
        k = coeff["k"]
        r0 = coeff["r0"]

        # set the parameters for the appropriate type
        return hoomd.make_scalar2(k, r0)

Example #8

File: external.py Project: episodeyang/EonHe_HOOMD

    def process_coeff(self, coeff):
	gamma = coeff['gamma'];
	npower = coeff['npower'];
       
        return hoomd.make_scalar2(gamma, npower);

Example #9

File: pair.py Project: martbert/hoomd0.11_plugins

 def process_coeff(self, coeff):
     a = coeff['A']
     gamma = 0
     return hoomd.make_scalar2(a, gamma)

Example #10

File: pair.py Project: martbert/hoomd0.11_plugins

    def process_coeff(self, coeff):
        epsilon = coeff['epsilon']
        kappa = coeff['kappa']

        return hoomd.make_scalar2(epsilon, kappa)

Example #11

File: pair.py Project: martbert/hoomd0.11_plugins

    def process_coeff(self, coeff):
        epsilon = coeff['epsilon']
        sigma = coeff['sigma']

        return hoomd.make_scalar2(epsilon, sigma)

Example #12

 def process_coeff(self, coeff):
     epsilon = coeff['epsilon']
     kappa = coeff['kappa']
     return hoomd.make_walls_yukawa_params(
         hoomd.make_scalar2(epsilon, kappa),
         coeff['r_cut'] * coeff['r_cut'], coeff['r_extrap'])

Example #13

 def process_coeff(self, coeff):
     epsilon = coeff['epsilon']
     sigma = coeff['sigma']
     return hoomd.make_walls_gauss_params(
         hoomd.make_scalar2(epsilon, sigma),
         coeff['r_cut'] * coeff['r_cut'], coeff['r_extrap'])