| 000 | 00914 a2200229 4500 | ||
|---|---|---|---|
| 005 | 20250517063900.0 | ||
| 264 | 0 | _c20160329 | |
| 008 | 201603s 0 0 eng d | ||
| 022 | _a1549-9618 | ||
| 024 | 7 |
_a10.1021/ct3009683 _2doi |
|
| 040 |
_aNLM _beng _cNLM |
||
| 100 | 1 | _aBirgin, Ernesto G | |
| 245 | 0 | 0 |
_aSparse Projected-Gradient Method As a Linear-Scaling Low-Memory Alternative to Diagonalization in Self-Consistent Field Electronic Structure Calculations. _h[electronic resource] |
| 260 |
_bJournal of chemical theory and computation _cFeb 2013 |
||
| 300 |
_a1043-51 p. _bdigital |
||
| 500 | _aPublication Type: Journal Article | ||
| 700 | 1 | _aMartınez, J M | |
| 700 | 1 | _aMartınez, Leandro | |
| 700 | 1 | _aRocha, Gerd B | |
| 773 | 0 |
_tJournal of chemical theory and computation _gvol. 9 _gno. 2 _gp. 1043-51 |
|
| 856 | 4 | 0 |
_uhttps://doi.org/10.1021/ct3009683 _zAvailable from publisher's website |
| 999 |
_c25467885 _d25467885 |
||