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Description
  • Naše předchozí přesné CCSD(T) výpočty byly shrnuty do databáze pojmenované begdb – „Benchmark Energy and Geometry DataBase“. Databáze je umístěna na webu a je dostupná na adrese www.begdb.com. (cs)
  • Our previous benchmark CCSD(T)/ complete basis set limit calculations were collected into a database named begdb – Benchmark Energy and Geometry DataBase. Web-based interface to this database was prepared and is available at www.begdb.com.
  • Our previous benchmark CCSD(T)/ complete basis set limit calculations were collected into a database named begdb – Benchmark Energy and Geometry DataBase. Web-based interface to this database was prepared and is available at www.begdb.com. (en)
Title
  • Quantum chemical benchmark energy and geometry database for molecular clusters and complex molecular systems (www.begdb.com): a users manual and examples
  • Quantum chemical benchmark energy and geometry database for molecular clusters and complex molecular systems (www.begdb.com): a users manual and examples (en)
  • Kvantově-chemická databáze energií a geometrií molekulových klastrů a komplexních molekulových systémů (www.begdb.com): uživatelský manuál a příklady (cs)
skos:prefLabel
  • Quantum chemical benchmark energy and geometry database for molecular clusters and complex molecular systems (www.begdb.com): a users manual and examples
  • Quantum chemical benchmark energy and geometry database for molecular clusters and complex molecular systems (www.begdb.com): a users manual and examples (en)
  • Kvantově-chemická databáze energií a geometrií molekulových klastrů a komplexních molekulových systémů (www.begdb.com): uživatelský manuál a příklady (cs)
skos:notation
  • RIV/61388963:_____/08:00315732!RIV09-AV0-61388963
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(LC512), Z(AV0Z40550506), Z(MSM6198959216)
http://linked.open...iv/cisloPeriodika
  • 10
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
http://linked.open.../riv/druhVysledku
http://linked.open...iv/duvernostUdaju
http://linked.open...titaPredkladatele
http://linked.open...dnocenehoVysledku
  • 391261
http://linked.open...ai/riv/idVysledku
  • RIV/61388963:_____/08:00315732
http://linked.open...riv/jazykVysledku
http://linked.open.../riv/klicovaSlova
  • ab initio calculations; coupled cluster method; internet database (en)
http://linked.open.../riv/klicoveSlovo
http://linked.open...odStatuVydavatele
  • CZ - Česká republika
http://linked.open...ontrolniKodProRIV
  • [4B1CEAEFF7CD]
http://linked.open...i/riv/nazevZdroje
  • Collection of Czechoslovak Chemical Communications
http://linked.open...in/vavai/riv/obor
http://linked.open...ichTvurcuVysledku
http://linked.open...cetTvurcuVysledku
http://linked.open...vavai/riv/projekt
http://linked.open...UplatneniVysledku
http://linked.open...v/svazekPeriodika
  • 73
http://linked.open...iv/tvurceVysledku
  • Hobza, Pavel
  • Riley, Kevin Eugene
  • Vondrášek, Jiří
  • Černý, Jiří
  • Řezáč, Jan
  • Berka, Karel
  • Pitoňák, Michal
  • Řezáč, Tomáš
  • Jurečka, Petr
  • Pluháčková, Kristýna
  • Valdes, Haydee
http://linked.open...ain/vavai/riv/wos
  • 000263121400003
http://linked.open...n/vavai/riv/zamer
issn
  • 0010-0765
number of pages
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