From owner-chemistry@ccl.net Mon Sep 11 10:22:01 2017 From: "Norrby, Per-Ola Per-Ola.Norrby+*+astrazeneca.com" To: CCL Subject: CCL: Correctly evaluating spin states of a cobalt trimer (using Single Points)? Message-Id: <-52995-170911020243-19954-0Pb050IZIVtH9GEVulwfgw-.-server.ccl.net> X-Original-From: "Norrby, Per-Ola" Content-Language: en-US Content-Type: multipart/alternative; boundary="_000_HE1PR04MB209236A3CE9BDA78EC785BFBCA680HE1PR04MB2092eurp_" Date: Mon, 11 Sep 2017 06:02:32 +0000 MIME-Version: 1.0 Sent to CCL by: "Norrby, Per-Ola" [Per-Ola.Norrby%x%astrazeneca.com] --_000_HE1PR04MB209236A3CE9BDA78EC785BFBCA680HE1PR04MB2092eurp_ Content-Type: text/plain; charset="utf-8" Content-Transfer-Encoding: base64 RGVhciBIZW5yaXF1ZSwNCg0KRXhjZWxsZW50IHN1bW1hcnkgYnkgU2VyZ2lvLiBJIGhhdmUgYSBj b3VwbGUgb2YgcmVpbmZvcmNlbWVudHMgYW5kIGFkZGl0aW9ucy4NCg0KWWVzLCB5b3UgbXVzdCBv cHRpbWl6ZSB0aGUgZ2VvbWV0cnkuIFNvbWV0aW1lcyBpdCdzIGdvb2QgcHJhY3RpY2UgdG8gZnJl ZXplIG9uZSByZW1vdGUgYXRvbSBwZXIgbGlnYW5kIChub3QgYSBoeWRyb2dlbiwgYW5kIGF0IGxl YXN0IDMgYm9uZHMgZnJvbSBhbnkgbWV0YWwpLCB0byBhdm9pZCBsYXJnZSBzaGlmdHMgaW4gdGhl IGxpZ2FuZCBnZW9tZXRyeS4gWW91IG11c3QgZG8gdGhpcyB0byBpZGVudGlmeSB0aGUgbG93ZXN0 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