Constants: Difference between revisions
From Intelligent Materials and Systems Lab
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1 kcal/mol = 6.94768e-3 mdyn*Å | 1 kcal/mol = 6.94768e-3 mdyn*Å | ||
Number of units in simulation cell: n=rho*V*Na/M | |||
Revision as of 15:38, 9 March 2007
Avogadro's Number: N_A = 6.0221415e23 (1/mol)
Elementary Charge: e = 1.60217646e-19 C
1 kcal = 4184.00 J
1 kcal/mol = 6.94769e-21 J
1 mdyn = 1e-8 N
1 mdyn*Å = 1e-18 J = 143.933 kcal/mol
1 kcal/mol = 6.94768e-3 mdyn*Å
Number of units in simulation cell: n=rho*V*Na/M