![]() ![]() The links are given together with the corresponding options set for each link in a proprietary format. The keywords are transformed by Gaussian into a sequence of subroutine calls termed "links". Will use up to 8 processors via shared memory. SetSPE: set environment variable "MP_BIND" = "yes" The calculation performed here is the B3LYP/6-31+G(d,p) geometry optimization of the water dimer, complemented by the D3 dispersion correction. Subsequently the keywords used in the input file are repeated together with other general settings such as the amount of main memory available for the calculations (here 16000MB), and the location of a binary checkpoint file for storage of important results (here /scr1/zipse/17079/watdim01.chk). Fox, Gaussian, Inc., Wallingford CT, 2016.Īctual program output specific to a certain calculation starts with a statement of the program version (here Gaussian 16), program revision (here A.03), and the current date. It will not use this program in any manner prohibited above. Licensee that it is not a competitor of Gaussian, Inc. is engaged in theīusiness of creating and licensing software in the field ofĬomputational chemistry and represents and warrants to the The user acknowledges that Gaussian, Inc. Of this program is prohibited from giving any competitor of or will provideĪssistance to any competitor of Gaussian, Inc. Warning - This program may not be used in any manner thatĬompetes with the business of Gaussian, Inc. Subject to restrictions as set forth in subparagraphs (a)Īnd (c) of the Commercial Computer Software - Restrictedģ40 Quinnipiac St., Bldg. Use, reproduction and disclosure by the US Government is The following legend is applicable only to US Government Used, copied, transmitted, or stored only in accord with that This software is provided under written license and may be Including trade secrets, belonging to Gaussian, Inc. This software contains proprietary and confidential information, University), and the Gaussian 82(TM) system (copyright 1983,Ĭarnegie Mellon University). The Gaussian 86(TM) system (copyright 1986, Carnegie Mellon The Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.), The Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.), The Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.), The Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.), The Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.), The Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.), The Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.), This is part of the Gaussian(R) 16 program. Gaussian 16 is no public domain software!!Įntering Gaussian System, Link 0=/scr1/g16_a.03_sse4/g16/g16 The first part of the Gaussian 16 output file states in considerable detail the contents of the license agreement. ![]()
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