Hilabetekako artxiboa: August 2011

send_espresso

send_espresso Lanak kolara bidaltzeko send_espresso tresta egin dugu. Argumenturik gabe exekutatzen badugu laguntza erakusten digu: send_espresso input.in Executable Nodes Procs_per_node Time [Mem] [“Other queue options” ] input Kalkuluaren  inputaren izena (extensiorik gabe) Executable Erabiltzea nahi den espressoren exekutagarria:pw.x, ph.x,… Nodes … Jarraitu irakurtzen

Kategoriak Lanak Bidaltzeko | Comments Off on send_espresso

Turbomole

Presently TURBOMOLE is one of the fastest and most stable codes available for standard quantum chemical applications. Unlike many other programs, the main focus in the development of TURBOMOLE has not been to implement all new methods and functionals, but to … Jarraitu irakurtzen

Kategoriak Kalkulu Softwarea, Quantum mechanics @eu, Softwarea | Utzi iruzkina