Matches in SemOpenAlex for { <https://semopenalex.org/work/W2465332004> ?p ?o ?g. }
- W2465332004 endingPage "64" @default.
- W2465332004 startingPage "53" @default.
- W2465332004 abstract "We present a novel density-functional tight-binding (DFTB) parametrization toolkit developed to optimize the parameters of various DFTB models in a fully automatized fashion. The main features of the algorithm, based on the particle swarm optimization technique, are discussed, and a number of initial pilot applications of the developed methodology to molecular and solid systems are presented." @default.
- W2465332004 created "2016-07-22" @default.
- W2465332004 creator A5013124740 @default.
- W2465332004 creator A5034227537 @default.
- W2465332004 creator A5036371161 @default.
- W2465332004 creator A5038313442 @default.
- W2465332004 creator A5064284471 @default.
- W2465332004 creator A5084430474 @default.
- W2465332004 date "2015-12-09" @default.
- W2465332004 modified "2023-10-14" @default.
- W2465332004 title "Automatized Parameterization of DFTB Using Particle Swarm Optimization" @default.
- W2465332004 cites W1527708859 @default.
- W2465332004 cites W1561267047 @default.
- W2465332004 cites W1849384523 @default.
- W2465332004 cites W1965452714 @default.
- W2465332004 cites W1968166922 @default.
- W2465332004 cites W1968965587 @default.
- W2465332004 cites W1970127494 @default.
- W2465332004 cites W1970705175 @default.
- W2465332004 cites W1972124922 @default.
- W2465332004 cites W1973529050 @default.
- W2465332004 cites W1974351821 @default.
- W2465332004 cites W1974905452 @default.
- W2465332004 cites W1976229637 @default.
- W2465332004 cites W1976541590 @default.
- W2465332004 cites W1977456707 @default.
- W2465332004 cites W1979544533 @default.
- W2465332004 cites W1980298982 @default.
- W2465332004 cites W1981146351 @default.
- W2465332004 cites W1981263705 @default.
- W2465332004 cites W1981368803 @default.
- W2465332004 cites W1982632419 @default.
- W2465332004 cites W1983493485 @default.
- W2465332004 cites W1985154199 @default.
- W2465332004 cites W1996574013 @default.
- W2465332004 cites W1997231673 @default.
- W2465332004 cites W2000435576 @default.
- W2465332004 cites W2002484561 @default.
- W2465332004 cites W2005779271 @default.
- W2465332004 cites W2007395042 @default.
- W2465332004 cites W2009231084 @default.
- W2465332004 cites W2010222331 @default.
- W2465332004 cites W2012877196 @default.
- W2465332004 cites W2014953663 @default.
- W2465332004 cites W2016168218 @default.
- W2465332004 cites W2017534674 @default.
- W2465332004 cites W2018120102 @default.
- W2465332004 cites W2021911299 @default.
- W2465332004 cites W2022017520 @default.
- W2465332004 cites W2022696619 @default.
- W2465332004 cites W2023628624 @default.
- W2465332004 cites W2025136035 @default.
- W2465332004 cites W2029075848 @default.
- W2465332004 cites W2031293469 @default.
- W2465332004 cites W2033464917 @default.
- W2465332004 cites W2035174302 @default.
- W2465332004 cites W2043528684 @default.
- W2465332004 cites W2045645774 @default.
- W2465332004 cites W2051831029 @default.
- W2465332004 cites W2052415011 @default.
- W2465332004 cites W2054299280 @default.
- W2465332004 cites W2054413582 @default.
- W2465332004 cites W2054704030 @default.
- W2465332004 cites W2060410316 @default.
- W2465332004 cites W2060640563 @default.
- W2465332004 cites W2062956763 @default.
- W2465332004 cites W2067269972 @default.
- W2465332004 cites W2069037684 @default.
- W2465332004 cites W2071312077 @default.
- W2465332004 cites W2074152022 @default.
- W2465332004 cites W2075966481 @default.
- W2465332004 cites W2076757204 @default.
- W2465332004 cites W2079105963 @default.
- W2465332004 cites W2083222334 @default.
- W2465332004 cites W2086291460 @default.
- W2465332004 cites W2087698390 @default.
- W2465332004 cites W2090786203 @default.
- W2465332004 cites W2092077040 @default.
- W2465332004 cites W2092246753 @default.
- W2465332004 cites W2102254026 @default.
- W2465332004 cites W2111983136 @default.
- W2465332004 cites W2121624572 @default.
- W2465332004 cites W2138402460 @default.
- W2465332004 cites W2151430724 @default.
- W2465332004 cites W2156454991 @default.
- W2465332004 cites W2161005095 @default.
- W2465332004 cites W2312952152 @default.
- W2465332004 cites W2323159942 @default.
- W2465332004 cites W2327161550 @default.
- W2465332004 cites W2327518636 @default.
- W2465332004 cites W2331775690 @default.
- W2465332004 cites W2331880329 @default.
- W2465332004 cites W2333538638 @default.
- W2465332004 cites W2334877962 @default.
- W2465332004 cites W2915239894 @default.
- W2465332004 cites W4245989841 @default.
- W2465332004 doi "https://doi.org/10.1021/acs.jctc.5b00673" @default.
- W2465332004 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/26587758" @default.