| CPC C30B 15/20 (2013.01) [C30B 29/06 (2013.01); G06F 30/20 (2020.01); G06F 2111/10 (2020.01)] | 6 Claims |

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1. A method of producing a silicon single crystal based on concentration profiles of vacancies and interstitial silicon atoms during pulling of a silicon single crystal by a Czochralski process, the concentration profiles being calculated using a convection-diffusion equation, the method comprising:
determining a concentration Cveq of vacancies in thermal equilibrium represented by an equation (A) shown below and a concentration CIeq of interstitial silicon atoms in thermal equilibrium represented by an equation (B) shown below in the convection-diffusion equation by fitting calculation results to experimental results by using as a fitting parameter, one of a first stress coefficient avf in the equation (A) and a second stress coefficient aIf in the equation (B) and setting the other to be a fixed value obtained by a calculation approach,
![]() wherein in the equations (A) and (B), T is a temperature, P is a stress, C0,V and C0,I are constants, kB is the Boltzmann constant, Evf is a formation energy of a vacancy, and EIf is a formation energy of an interstitial silicon atom;
calculating the concentration profiles of each of the vacancies and the interstitial silicon atoms during the pulling of the silicon single crystal by the Czochralski process using the convection-diffusion equation for a design of a single crystal pulling apparatus;
repeating changing the design and calculating the concentration profiles of each of the vacancies and the interstitial silicon atoms for the changed design until a condition under which a defect-free silicon single crystal can be obtained is found;
manufacturing the single crystal pulling apparatus in accordance with the design which can produce a defect-free silicon single crystal; and
producing a defect-free silicon single crystal using the manufactured single crystal pulling apparatus under the condition under which a defect-free silicon single crystal can be obtained.
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